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Complexes

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compound_name
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metal
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dioury2014
10.1021/ci500346w
10.1002/hlca.19540370402
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
105
trans-1,2-CDTA
O=C(O)CN(CC(=O)O)C1CCCCC1N(CC(=O)O)CC(=O)O
ligand
Gd
18,77
33
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1016/0022-1902(62)80018-9
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
105
trans-1,2-CDTA
O=C(O)CN(CC(=O)O)C1CCCCC1N(CC(=O)O)CC(=O)O
ligand
Gd
18,8
33
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1016/s0003-2670(00)84867-9
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
105
trans-1,2-CDTA
O=C(O)CN(CC(=O)O)C1CCCCC1N(CC(=O)O)CC(=O)O
ligand
Gd
18,97
33
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1002/chin.198535056
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
105
trans-1,2-CDTA
O=C(O)CN(CC(=O)O)C1CCCCC1N(CC(=O)O)CC(=O)O
ligand
Gd
19,5
33
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1002/hlca.19640470715
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
106
TMTA
O=C(O)CN(CCCN(CC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
13,74
33
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1002/ejic.201101294
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
107
DMPDTA
CC(C)(CN(CC(=O)O)CC(=O)O)CN(CC(=O)O)CC(=O)O
ligand
Gd
12,3
34
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1021/ic00224a041
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
108
DHPTA
O=C(O)CN(CC(=O)O)CC(O)CN(CC(=O)O)CC(=O)O
ligand
Gd
13,94
34
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1016/s0277-5387(00)87165-x
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
109
PMDTA
O=C(O)CN(CCCCCN(CC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
10,37
34
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1021/ic00178a027
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
110
BPETA
O=C(O)CN(CCCOCCCN(CC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
11,74
34
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1021/j100808a028
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
111
EGTA
O=C(O)CN(CCOCCOCCN(CC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
16,94
34
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1021/j100808a028
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
111
EGTA
O=C(O)CN(CCOCCOCCN(CC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
17,5
34
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1246/bcsj.66.3377
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
112
BAPTA
O=C(O)CN(CC(=O)O)c1ccccc1OCCOc1ccccc1N(CC(=O)O)CC(=O)O
ligand
Gd
10,6
34
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1002/jccs.199000033
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
112
BAPTA
O=C(O)CN(CC(=O)O)c1ccccc1OCCOc1ccccc1N(CC(=O)O)CC(=O)O
ligand
Gd
10,94
34
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1021/ic00213a019
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
113
DETAP
O=C(O)CCN(CCOCCN(CC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
15,21
34
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1039/b416150e
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
114
bpeda
O=C(O)CN(CCN(CC(=O)O)Cc1cccc(C(=O)O)n1)Cc1cccc(C(=O)O)n1
ligand
Gd
15,1
34
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1021/ic00234a009
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
115
MEDTA
CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
12,98
34
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1021/ic50181a065
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
116
BEDTA
O=C(O)CN(CCN(CC(=O)O)Cc1ccccc1)CC(=O)O
ligand
Gd
12,4
34
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1016/s0010-8545(99)00237-4
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
116
BEDTA
O=C(O)CN(CCN(CC(=O)O)Cc1ccccc1)CC(=O)O
ligand
Gd
12,58
34
table S5
1
title
13
table S2
dioury2014
10.1021/ci500346w
10.1016/0020-1693(94)04398-f
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
117
HBET
O=C(O)CN(CCN(CC(=O)O)Cc1ccccc1O)CC(=O)O
ligand
Gd
17,54
34
table S5
1
title
14
table S2
dioury2014
10.1021/ci500346w
10.1515/znc-1997-7-814
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
118
PEDTA
O=C(O)CN(CCN(CC(=O)O)Cc1ccccn1)CC(=O)O
ligand
Gd
15,56
34
table S5
1
title
14
table S2
dioury2014
10.1021/ci500346w
10.1016/0022-1902(77)80538-1
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
119
HEDTA
O=C(O)CN(CCO)CCN(CC(=O)O)CC(=O)O
ligand
Gd
14,8
34
table S5
1
title
14
table S2
dioury2014
10.1021/ci500346w
10.1021/ja01582a007
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
119
HEDTA
O=C(O)CN(CCO)CCN(CC(=O)O)CC(=O)O
ligand
Gd
15,1
34
table S5
1
title
14
table S2
dioury2014
10.1021/ci500346w
10.1021/ja01582a007
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
119
HEDTA
O=C(O)CN(CCO)CCN(CC(=O)O)CC(=O)O
ligand
Gd
15,4
34
table S5
1
title
14
table S2
dioury2014
10.1021/ci500346w
10.1016/s0020-1693(00)84982-8
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
120
HPED
O=C(O)CN(CCN(CC(=O)O)c1ccccc1O)c1ccccc1O
ligand
Gd
21,18
34
table S5
1
title
14
table S2
dioury2014
10.1021/ci500346w
10.1021/ic9613016
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
121
BPED
O=C(O)CN(CCN(CC(=O)O)Cc1ccccn1)Cc1ccccn1
ligand
Gd
12,37
34
table S5
1
title
14
table S2
dioury2014
10.1021/ci500346w
10.1021/ic00006a021
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
122
HEHA
O=C(O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1
ligand
Gd
22,95
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.1021/ic00006a021
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
123
PEPA
O=C(O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1
ligand
Gd
15,88
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.1021/ic00046a015
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
124
DTPA-EAM
O=C(O)CN1CCN(CC(=O)O)CC(=O)NCCNC(=O)CN(CC(=O)O)CC1
ligand
Gd
11,15
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.1021/ic00091a032
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
124
DTPA-EAM
O=C(O)CN1CCN(CC(=O)O)CC(=O)NCCNC(=O)CN(CC(=O)O)CC1
ligand
Gd
11,4
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.5012/jkcs.2004.48.6.577
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
125
N-ac3[15]aneN3O2-bis
O=C(O)CN1CCOCCOCCN(CC(=O)O)CCN(CC(=O)O)CC1
ligand
Gd
9,98
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.5012/jkcs.2004.48.6.577
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
126
N-pr3[15]aneN3O2-bis
O=C(O)CCN1CCOCCOCCN(CCC(=O)O)CCN(CCC(=O)O)CC1
ligand
Gd
16,57
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.1006/mchj.1996.0026
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
127
N-pr3[15]aneN3O2
O=C(O)CCN1CCOCCN(CCC(=O)O)CCN(CCC(=O)O)CCOCC1
ligand
Gd
11,23
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.1016/j.tet.2006.10.024
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
128
cyclo-PCTA12
O=C(O)CN1CCN(CC(=O)O)C2CCCCC2N(CC(=O)O)Cc2cccc(n2)C1
ligand
Gd
null
34
table S5
1
title
null
null
dioury2014
10.1021/ci500346w
10.1016/j.tet.2009.06.117
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
129
amido-cyclo-PCTA12
O=C(O)CN1CC(=O)NC2CCCCC2N(CC(=O)O)Cc2cccc(n2)C1
ligand
Gd
null
34
table S5
1
title
null
null
dioury2014
10.1021/ci500346w
10.1007/bf02594595
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
130
P730-1
O=C(O)CCC(C(=O)O)N1CCN(CC(=O)O)CCN(C(CCC(=O)O)C(=O)O)CCN(C(CCC(=O)O)C(=O)O)CC1
ligand
Gd
null
34
table S5
1
title
null
null
dioury2014
10.1021/ci500346w
10.1021/ja101518v
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
131
DOTA(GA)2
O=C(O)CCC(C(=O)O)N1CCN(CC(=O)O)CCN(CC(=O)O)CCN(C(CCC(=O)O)C(=O)O)CC1
ligand
Gd
null
34
table S5
1
title
null
null
dioury2014
10.1021/ci500346w
10.1021/ja101518v
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
132
DOTAGA
O=C(O)CCC(C(=O)O)N1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1
ligand
Gd
null
34
table S5
1
title
null
null
dioury2014
10.1021/ci500346w
10.1002/hlca.200590044
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
133
DOTABA
O=C(O)CN1CCN(CC(=O)O)CCN(C(C(=O)O)c2ccc(C(=O)O)cc2)CCN(CC(=O)O)CC1
ligand
Gd
null
34
table S5
1
title
null
null
dioury2014
10.1021/ci500346w
10.1002/hlca.200590044
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
134
DOTASA
O=C(O)CC(C(=O)O)N1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1
ligand
Gd
27,2
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.1016/j.tetlet.2012.11.151
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
135
DOTA-hydrazide
NNC(=O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1
ligand
Gd
null
34
table S5
1
title
null
null
dioury2014
10.1021/ci500346w
10.1021/ic00038a023
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
136
DO3A-L1
CN(CC(O)C(O)C(O)C(O)CO)C(=O)C(COCc1ccccc1)N1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1
ligand
Gd
26,4
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.1021/ic00038a023
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
137
DO3A-L2
O=C(O)CN1CCN(CC(=O)O)CCN(C(COCc2ccccc2)C(=O)NC(CO)CO)CCN(CC(=O)O)CC1
ligand
Gd
25,9
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.1021/ic00065a019
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
138
(R,R,R)-DO3MA
CC(C(=O)O)N1CCNCCN(C(C)C(=O)O)CCN(C(C)C(=O)O)CC1
ligand
Gd
25,3
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.1039/a803565b
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
139
DO2A
O=C(O)CN1CCNCCN(CC(=O)O)CCNCC1
ligand
Gd
13,06
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.1021/ic961131x
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
139
DO2A
O=C(O)CN1CCNCCN(CC(=O)O)CCNCC1
ligand
Gd
19,1
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.1021/ic961131x
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
139
DO2A
O=C(O)CN1CCNCCN(CC(=O)O)CCNCC1
ligand
Gd
19,4
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.1021/ic202436j
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
140
DODPA
O=C(O)c1cccc(CN2CCNCCN(Cc3cccc(C(=O)O)n3)CCNCC2)n1
ligand
Gd
null
34
table S5
1
title
null
null
dioury2014
10.1021/ci500346w
10.1021/ic202436j
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
141
MeDODPA
CN1CCN(Cc2cccc(C(=O)O)n2)CCN(C)CCN(Cc2cccc(C(=O)O)n2)CC1
ligand
Gd
null
34
table S5
1
title
null
null
dioury2014
10.1021/ci500346w
10.1016/0022-1902(81)80122-4
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
142
TTHA
O=C(O)CN(CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O
ligand
Gd
19,51
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.1016/0223-5234(88)90094-3
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
142
TTHA
O=C(O)CN(CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O
ligand
Gd
28,4
34
table S5
1
title
21
table S3
dioury2014
10.1021/ci500346w
10.1021/jm980152t
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
143
PNP-DTPA
O=C(O)CN(CCN(CC(=O)O)CC(Cc1ccc([N+](=O)[O-])cc1)N(CC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
null
35
table S5
1
title
null
null
dioury2014
10.1021/ci500346w
10.1021/jm980152t
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
144
PNPM-DTPA
CC(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(Cc1ccc([N+](=O)[O-])cc1)N(CC(=O)O)CC(=O)O
ligand
Gd
null
35
table S5
1
title
null
null
dioury2014
10.1021/ci500346w
10.1021/ic951326p
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
145
rac-trans-CHX-DTPA
O=C(O)CN(CCN(CC(=O)O)C1CCCCC1N(CC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
null
35
table S5
1
title
null
null
dioury2014
10.1021/ci500346w
10.1007/bf00759053
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
146
CEDTA
O=C(O)CCN(CCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O
ligand
Gd
16,71
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1007/bf00759053
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
146
CEDTA
O=C(O)CCN(CCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O
ligand
Gd
18,4
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1002/chem.200204612
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
147
EPTPA
O=C(O)CN(CCCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O
ligand
Gd
17,5
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1002/chem.200204612
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
147
EPTPA
O=C(O)CN(CCCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O
ligand
Gd
18,75
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1039/a805837g
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
147
EPTPA
O=C(O)CN(CCCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O
ligand
Gd
22,77
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1002/1522-2675(200204)85:4<1033::aid-hlca1033>3.0.co;2-n
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
148
(S)-EPTPA-bz
O=C(O)CN(CCCN(CC(=O)O)CC(Cc1ccccc1)N(CC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
23,79
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1039/b107456n
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
149
TTDA-PY
O=C(O)CN(CCCN(CCN(CC(=O)O)CC(=O)O)Cc1ccccn1)CC(=O)O
ligand
Gd
23,48
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1097/00004424-199009001-00026
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
150
DTPA-BEA
CCNC(=O)CN(CCN(CCN(CC(=O)O)CC(=O)NCC)CC(=O)O)CC(=O)O
ligand
Gd
15,34
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1097/00004424-199009001-00026
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
151
DTPA-BHeptA
CCCCCCCNC(=O)CN(CCN(CCN(CC(=O)O)CC(=O)NCCCCCCC)CC(=O)O)CC(=O)O
ligand
Gd
15,62
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1097/00004424-199111001-00074
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
152
DTPA-MPEA2
O=C(O)CN(CCN(CC(=O)O)CC(=O)NCCN1CCOCC1)CCN(CC(=O)O)CC(=O)NCCN1CCOCC1
ligand
Gd
16,1
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1097/00004424-199009001-00026
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
152
DTPA-MPEA2
O=C(O)CN(CCN(CC(=O)O)CC(=O)NCCN1CCOCC1)CCN(CC(=O)O)CC(=O)NCCN1CCOCC1
ligand
Gd
20,82
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1002/mrm.1910080208
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
153
DTPA-APD
O=C(O)CN(CCN(CC(=O)O)CC(=O)NCC(O)CO)CCN(CC(=O)O)CC(=O)NCC(O)CO
ligand
Gd
15,32
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1097/00004424-199111001-00074
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
154
DTPA-BMMOA
CN(CCN1CCOCC1)C(=O)CN(CCN(CCN(CC(=O)O)CC(=O)N(C)CCN1CCOCC1)CC(=O)O)CC(=O)O
ligand
Gd
20,3
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1016/0022-1902(71)80023-4
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
155
rac-trans-BDTA
CC(C(C)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O
ligand
Gd
18,64
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1016/s0003-2670(01)95804-0
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
155
rac-trans-BDTA
CC(C(C)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O
ligand
Gd
18,78
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1021/ac60243a032
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
155
rac-trans-BDTA
CC(C(C)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O
ligand
Gd
18,84
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1016/0022-1902(71)80024-6
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
155
rac-trans-BDTA
CC(C(C)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O
ligand
Gd
16,51
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1016/0022-1902(71)80023-4
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
155
rac-trans-BDTA
CC(C(C)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O
ligand
Gd
17,03
35
table S5
1
title
22
table S3
dioury2014
10.1021/ci500346w
10.1016/s0020-1693(00)80040-7
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
156
ENDPDA
O=C(O)CCN(CCN(CCC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
11,83
35
table S5
1
title
23
table S3
dioury2014
10.1021/ci500346w
10.1016/s0020-1693(00)80040-7
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
156
ENDPDA
O=C(O)CCN(CCN(CCC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
13,21
35
table S5
1
title
23
table S3
dioury2014
10.1021/ci500346w
10.1016/0022-1902(81)80122-4
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
156
ENDPDA
O=C(O)CCN(CCN(CCC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
15,35
35
table S5
1
title
23
table S3
dioury2014
10.1021/ci500346w
10.1021/j100808a028
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
157
EEDTA
O=C(O)CN(CCOCCN(CC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
18,13
35
table S5
1
title
23
table S3
dioury2014
10.1021/ci500346w
10.1021/j100808a028
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
157
EEDTA
O=C(O)CN(CCOCCN(CC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
18,21
35
table S5
1
title
23
table S3
dioury2014
10.1021/ci500346w
10.1007/978-1-4613-4452-0
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
157
EEDTA
O=C(O)CN(CCOCCN(CC(=O)O)CC(=O)O)CC(=O)O
ligand
Gd
18,3
35
table S5
1
title
23
table S3
dioury2014
10.1021/ci500346w
10.1016/0020-1693(94)04012-5
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
158
HBED
O=C(O)CN(CCN(CC(=O)O)Cc1ccccc1O)Cc1ccccc1O
ligand
Gd
18,89
35
table S5
1
title
23
table S3
dioury2014
10.1021/ci500346w
10.1515/ci.2000.22.1.24a
1
QSPR Prediction of the Stability Constants of Gadolinium(III) Complexes for Magnetic Resonance Imaging
American Chemical Society (ACS)
2,014
0
158
HBED
O=C(O)CN(CCN(CC(=O)O)Cc1ccccc1O)Cc1ccccc1O
ligand
Gd
19,16
35
table S5
1
title
23
table S3
bartholoma2010
10.1021/cr1000755
10.1021/cr1000755
0
Technetium and Gallium Derived Radiopharmaceuticals: Comparing and Contrasting the Chemistry of Two Important Radiometals for the Molecular Imaging Era
American Chemical Society (ACS)
2,010
0
null
TRODAT
CN1C2CCC1C(CN(CC[S-])CCNCC[S-])C(c1ccc(Cl)cc1)C2.[O-]
environment
Tc
null
4
figure 3
3
subtitle 2
null
null
bartholoma2010
10.1021/cr1000755
10.1021/cr1000755
0
Technetium and Gallium Derived Radiopharmaceuticals: Comparing and Contrasting the Chemistry of Two Important Radiometals for the Molecular Imaging Era
American Chemical Society (ACS)
2,010
0
null
tretroformin
CCOCCP(CCOCC)CCP(CCOCC)CCOCC.CCOCCP(CCOCC)CCP(CCOCC)CCOCC.[O-2].[O-2]
environment
Tc
null
4
figure 2
3
subtitle 2
null
null
bartholoma2010
10.1021/cr1000755
10.1021/cr1000755
0
Technetium and Gallium Derived Radiopharmaceuticals: Comparing and Contrasting the Chemistry of Two Important Radiometals for the Molecular Imaging Era
American Chemical Society (ACS)
2,010
0
null
bicisate
CCOC(=O)C([N-]CCNC(C(=O)OCC)C(C)(C)[S-])C(C)(C)[S-].[O-2]
environment
Tc
null
4
figure 2
3
subtitle 2
null
null
bartholoma2010
10.1021/cr1000755
10.1021/cr1000755
0
Technetium and Gallium Derived Radiopharmaceuticals: Comparing and Contrasting the Chemistry of Two Important Radiometals for the Molecular Imaging Era
American Chemical Society (ACS)
2,010
0
null
MAG3
O=C(O)C[N-]C(=O)C[N-]C(=O)C[N-]C(=O)C[S-].[O-2]
environment
Tc
null
4
figure 2
3
subtitle 2
null
null
bartholoma2010
10.1021/cr1000755
10.1021/cr1000755
0
Technetium and Gallium Derived Radiopharmaceuticals: Comparing and Contrasting the Chemistry of Two Important Radiometals for the Molecular Imaging Era
American Chemical Society (ACS)
2,010
0
null
sestamibi
[C-]#[N+]CC(C)(C)OC.[C-]#[N+]CC(C)(C)OC.[C-]#[N+]CC(C)(C)OC.[C-]#[N+]CC(C)(C)OC.[C-]#[N+]CC(C)(C)OC.[C-]#[N+]CC(C)(C)OC
environment
Tc
null
4
figure 2
3
subtitle 2
null
null
bartholoma2010
10.1021/cr1000755
10.1021/cr1000755
0
Technetium and Gallium Derived Radiopharmaceuticals: Comparing and Contrasting the Chemistry of Two Important Radiometals for the Molecular Imaging Era
American Chemical Society (ACS)
2,010
0
null
teboroxime
C[B-](ON=C1CCCCC1=N[O-])(ON=C1CCCCC1=NO)ON=C1CCCCC1=NO.[Cl-]
environment
Tc
null
4
figure 2
3
subtitle 2
null
null
bartholoma2010
10.1021/cr1000755
10.1021/cr1000755
0
Technetium and Gallium Derived Radiopharmaceuticals: Comparing and Contrasting the Chemistry of Two Important Radiometals for the Molecular Imaging Era
American Chemical Society (ACS)
2,010
0
null
oxo
[O-2].[S-]CCNCCNCC[S-]
environment
Tc
null
5
figure 6
3
subtitle 2
null
null
bartholoma2010
10.1021/cr1000755
10.1021/cr1000755
0
Technetium and Gallium Derived Radiopharmaceuticals: Comparing and Contrasting the Chemistry of Two Important Radiometals for the Molecular Imaging Era
American Chemical Society (ACS)
2,010
0
null
tricarbonyl
N=Nc1ccccn1.[N-2]Nc1cccc[nH+]1.[S-]CCSCC[S-]
environment
Tc
null
5
figure 6
3
subtitle 2
null
null
abram2006
10.1590/S0103-50532006000800004
10.1590/S0103-50532006000800004
0
Technetium and rhenium: coordination chemistry and nuclear medical applications
FapUNIFESP (SciELO)
2,006
1
null
DTPA
O=C([O-])CN(CCN(CC(=O)[O-])CC(=O)[O-])CCN(CC(=O)[O-])CC(=O)[O-]
environment
Tc
null
3
figure 1
3
subtitle 2
null
null
abram2006
10.1590/S0103-50532006000800004
10.1590/S0103-50532006000800004
0
Technetium and rhenium: coordination chemistry and nuclear medical applications
FapUNIFESP (SciELO)
2,006
1
null
EHIDA
CCc1cccc(CC)c1NC(=O)CN(CC(=O)O)CC(=O)O
ligand
Tc
null
3
figure 1
3
subtitle 2
null
null
abram2006
10.1590/S0103-50532006000800004
10.1590/S0103-50532006000800004
0
Technetium and rhenium: coordination chemistry and nuclear medical applications
FapUNIFESP (SciELO)
2,006
1
null
MDP
O=P([O-])(O)CP(=O)([O-])O.O=P([O-])(O)CP(=O)([O-])O.[OH-].[OH-]
environment
Tc
null
3
figure 1
3
subtitle 2
null
null
abram2006
10.1590/S0103-50532006000800004
10.1590/S0103-50532006000800004
0
Technetium and rhenium: coordination chemistry and nuclear medical applications
FapUNIFESP (SciELO)
2,006
1
null
MAG3
O=C(O)C[N-]C(=O)C[N-]C(=O)C[N-]C(=O)C[S-].[O-2]
environment
Tc
null
4
figure 2
3
subtitle 2
null
null
abram2006
10.1590/S0103-50532006000800004
10.1590/S0103-50532006000800004
0
Technetium and rhenium: coordination chemistry and nuclear medical applications
FapUNIFESP (SciELO)
2,006
1
3A
sestamibi
[C-]#[N+]CC(C)(C)OC.[C-]#[N+]CC(C)(C)OC.[C-]#[N+]CC(C)(C)OC.[C-]#[N+]CC(C)(C)OC.[C-]#[N+]CC(C)(C)OC.[C-]#[N+]CC(C)(C)OC
environment
Tc
null
5
figure 3
3
subtitle 2
null
null
abram2006
10.1590/S0103-50532006000800004
10.1590/S0103-50532006000800004
0
Technetium and rhenium: coordination chemistry and nuclear medical applications
FapUNIFESP (SciELO)
2,006
1
3B
tretroformin
CCOCCP(CCOCC)CCP(CCOCC)CCOCC.CCOCCP(CCOCC)CCP(CCOCC)CCOCC.[O-2].[O-2]
environment
Tc
null
5
figure 3
3
subtitle 2
null
null
abram2006
10.1590/S0103-50532006000800004
10.1590/S0103-50532006000800004
0
Technetium and rhenium: coordination chemistry and nuclear medical applications
FapUNIFESP (SciELO)
2,006
1
3C
null
COCCCP(CCCOC)CCCOC.COCCCP(CCCOC)CCCOC.C[N+](=CC1=C([O-])C(C)(C)OC1(C)C)CC[N+](C)=CC1=C([O-])C(C)(C)OC1(C)C
environment
Tc
null
5
figure 3
3
subtitle 2
null
null
abram2006
10.1590/S0103-50532006000800004
10.1590/S0103-50532006000800004
0
Technetium and rhenium: coordination chemistry and nuclear medical applications
FapUNIFESP (SciELO)
2,006
1
3D
teboroxime
C[B-](ON=C1CCCCC1=N[O-])(ON=C1CCCCC1=NO)ON=C1CCCCC1=NO.[Cl-]
environment
Tc
null
5
figure 3
3
subtitle 2
null
null
abram2006
10.1590/S0103-50532006000800004
10.1590/S0103-50532006000800004
0
Technetium and rhenium: coordination chemistry and nuclear medical applications
FapUNIFESP (SciELO)
2,006
1
3E
null
CCN(C(=S)[S-])C(C)(C)OC.CCN(C(=S)[S-])C(C)(C)OC.[N-3]
environment
Tc
null
5
figure 3
3
subtitle 2
null
null
abram2006
10.1590/S0103-50532006000800004
10.1590/S0103-50532006000800004
0
Technetium and rhenium: coordination chemistry and nuclear medical applications
FapUNIFESP (SciELO)
2,006
1
4A
HMPAO
CC(=N[O-])C(C)(C)[N-]CC(C)(C)C[N-]C(C)(C)C(C)=NO
environment
Tc
null
6
figure 4
3
subtitle 2
null
null
abram2006
10.1590/S0103-50532006000800004
10.1590/S0103-50532006000800004
0
Technetium and rhenium: coordination chemistry and nuclear medical applications
FapUNIFESP (SciELO)
2,006
1
4B
ECD
CCOC(=O)C([N-]CCNC(C(=O)OCC)C(C)(C)[S-])C(C)(C)[S-]
environment
Tc
null
6
figure 4
3
subtitle 2
null
null
abram2006
10.1590/S0103-50532006000800004
10.1590/S0103-50532006000800004
0
Technetium and rhenium: coordination chemistry and nuclear medical applications
FapUNIFESP (SciELO)
2,006
1
4C
BATO
CC([O-])=CC(C)[N-]CC[N-]CC1=CCC=N1.[O-2]
environment
Tc
null
6
figure 4
3
subtitle 2
null
null
abram2006
10.1590/S0103-50532006000800004
10.1590/S0103-50532006000800004
0
Technetium and rhenium: coordination chemistry and nuclear medical applications
FapUNIFESP (SciELO)
2,006
1
6A
null
CN1C2CCC1C(C(C[S-])[N-]CCNCC[S-])C(c1ccc(Cl)cc1)C2.[O-2]
environment
Tc
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7
figure 6
3
subtitle 2
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