Dataset Viewer
Auto-converted to Parquet Duplicate
prompt
stringlengths
72
328
completion
stringlengths
17
265
help me improve hydrogen bond acceptors and H-bond donors of molecule CCOc1c(Cl)cccc1CC(=O)N1Cc2ccccc2OC[C@H]1C.
CCOc1c(CC(=O)N2Cc3ccccc3OC[C@H]2C)cccc1C(=NN)NN
Help me reduce the number of hydrogen bond donors in molecule Cc1cccc(Cn2c(=O)c(C(=O)NCN)nn(-c3ccc(F)cc3)c2=O)c1
Cc1cccc(Cn2c(=O)c(C(=O)Nc3ccccc3)nn(-c3ccc(F)cc3)c2=O)c1
help me improve H-bond donors and synthetic accessibility of molecule Cc1cc([N+](=O)[O-])nn1CC(=O)N(C)C1CCCCC1.
CN(C(=O)Cn1nc([N+](=O)[O-])cc1C(N)=[NH2+])C1CCCCC1
help me reduce molecular weight and improve QED score of molecule CCOc1cccc([C@H]2C[C@H]2NC(=O)c2cnn(C3CCCCC3)c2-c2cc(Cl)cc(Cl)c2)c1.
CCOc1cccc([C@H]2C[C@H]2NC(=O)c2cnn(C3CCCCC3)c2C)c1
Help me reduce the number of hydrogen bond donors in molecule Cc1nc(C[NH+]2CCC(C(=O)NCCC(C)O)CC2)cs1
CCC(C)(C)C(C)CCNC(=O)C1CC[NH+](Cc2csc(C)n2)CC1
help me reduce H-bond donors and improve QED score of molecule NC(=[NH2+])c1nc[nH]c1C(=O)N[C@@H]1CCN([C@H]2CCNC2=O)C1.
Cc1nc[nH]c1C(=O)N[C@@H]1CCN([C@H]2CCNC2=O)C1
Help me make the molecule COCCN1CC[C@H](NC(=O)Cn2ccnc2C)[C@H](C(C)=CCCBr)C1 with more hydrogen bond donors
COCCN1CC[C@H](NC(=O)Cn2ccnc2C)[C@H](O)C1
help me reduce QED score and improve molecular weight of molecule CC(C)[C@H](CNc1cc(N(C)C)ccn1)c1ccccc1.
Cc1cccc(N(C)c2ccnc(NC[C@H](c3ccccc3)C(C)C)c2)c1Cl
Help me reduce the QED of molecule COc1cc(F)cc(CNc2ccc(S[C@@H](C)C(=O)O)cc2)c1 to make it less like a drug
CC(C)c1cccc(Oc2cc(F)cc(CNc3ccc(S[C@@H](C)C(=O)O)cc3)c2)c1
help me reduce hydrogen bond acceptors and molecular weight and synthetic accessibility and improve QED score of molecule CC(C)C[NH+](CC(=O)[O-])C(F)(F)C[C@@H](NC(=O)N1CCCC[C@@H]1C[C@H](C)O)c1ccccc1.
C[C@H](O)C[C@H]1CCCCN1C(=O)N[C@H](CC(F)(F)F)c1ccccc1
Help me reduce the number of hydrogen bond donors in molecule C=CC(=CC(=CC)c1ccc(NC)c(C(=C)c2nc3c(-c4ccsc4)cncc3[nH]2)c1)N(C)C
C=CC(=CC(=CC)c1ccc(-c2ccc(C(C)(C)C)cc2)c(C(=C)c2nc3c(-c4ccsc4)cncc3[nH]2)c1)N(C)C
Help me make the molecule O=C(c1ccc(F)c(F)c1Nc1ccc(I)cc1F)N1CC(C2CCC(CCCC3CCCC3)CC2)C1 with more hydrogen bond acceptors
O=C(c1ccc(F)c(F)c1Nc1ccc(I)cc1F)N1CC(NCC2CCCC2)C1
help me reduce LogP value and improve hydrogen bond acceptors and H-bond donors and synthetic accessibility of molecule Cc1ccc(C)n1-c1ccc(C#N)cc1N.
Cc1ccc(B(O)O)n1-c1ccc(C#N)cc1N
help me reduce LogP value and improve synthetic accessibility of molecule O=C(Cc1ccc2nc[nH]c2c1)N[C@@H]1COCc2ccccc21.
CC(C[NH+](CC(=O)N[C@@H]1COCc2ccccc21)Cc1ccc2nc[nH]c2c1)C(=O)[O-]
help me reduce LogP value and improve hydrogen bond acceptors and rotatable bonds of molecule CC(C)(C)OC(=O)NC1(C(=O)NC(C#N)Cc2ccc(-c3ccc(F)c(C#N)c3)cc2)CCOCC1.
CC(=O)NC(C(=O)O)C(O)OC(=O)NC1(C(=O)NC(C#N)Cc2ccc(-c3ccc(F)c(C#N)c3)cc2)CCOCC1
help me improve hydrogen bond acceptors and H-bond donors of molecule CCS(=O)(=O)N(CC(F)F)c1sc2ccccc2c1C.
CCS(=O)(=O)N(CC(F)F)c1sc2ccccc2c1B(O)O
help me reduce hydrogen bond acceptors and H-bond donors of molecule O=S(=O)(Nc1cccc(-c2cn3c(B(O)O)csc3n2)c1)c1ccccc1F.
Cc1csc2nc(-c3cccc(NS(=O)(=O)c4ccccc4F)c3)cn12
help me reduce synthetic accessibility and improve QED score of molecule CCCC(CCBr)CC(C)(CCC)Sc1ccc(NC(=O)C2CCNCC2C)cc1.
CCCC(C)(C)Sc1ccc(NC(=O)C2CCNCC2C)cc1
help me reduce H-bond donors and improve LogP value of molecule C[C@@H](CCNC(=O)C1CCC(C)(C)CC1)NC(=O)CCC(F)NC(=O)C(=O)NN.
C[C@@H](CCNC(=O)C1CCC(C)(C)CC1)NC(=O)CCC(F)F
help me reduce H-bond donors and improve LogP value of molecule C=C(Cl)CN[C@H]1C[C@H]2CC[C@H]1N(C(=O)c1c(B(O)O)coc1C)C2.
C=C(Cl)CN[C@H]1C[C@H]2CC[C@H]1N(C(=O)c1c(C)coc1C)C2
help me reduce LogP value and improve hydrogen bond acceptors and molecular weight and synthetic accessibility of molecule O=C(c1ccc(-c2cccs2)o1)N(Cc1ccco1)C[C@H]1CCCO1.
CC(C[NH+](C[C@H]1CCCO1)CN(Cc1ccco1)C(=O)c1ccc(-c2cccs2)o1)C(=O)[O-]
help me reduce hydrogen bond acceptors and H-bond donors of molecule O=C(Nc1ccc(B(O)O)c(S(=O)(=O)N2CCOCC2)c1)C(c1ccccc1)[NH+]1CCCC1.
Cc1ccc(NC(=O)C(c2ccccc2)[NH+]2CCCC2)cc1S(=O)(=O)N1CCOCC1
Help me reduce the number of hydrogen bond acceptors in molecule O=C1CCCN1N1CCC(COC(CO)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2ccccc2)CC1
C=C(CC(OCC1(c2ccccc2)CCN(N2CCCC2=O)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1
help me reduce LogP value and QED score and improve synthetic accessibility of molecule C=C(C)CN[C@H]1CCN(C(=O)c2ccc(CC(C)C)cc2)C1.
C=C(C)CN[C@H]1CCN(C(=O)c2ccc(C[C@@H](C)C(N)=[NH2+])cc2)C1
Help me make the molecule C[C@H](NC(=O)CCc1cncs1)[C@@H](C)Nc1nc2ccccc2o1 with more hydrogen bond acceptors
CCC(CC)(CC)SC(NC(=O)CCc1cncs1)[C@@H](C)Nc1nc2ccccc2o1
help me reduce hydrogen bond acceptors and H-bond donors of molecule CCC(=O)Nc1ccc(C(=O)NCCNS(=O)(=O)c2ccc(OC)c(B(O)O)c2)cc1.
CCC(=O)Nc1ccc(C(=O)NCCNS(=O)(=O)c2ccc(OC)c(C)c2)cc1
help me reduce hydrogen bond acceptors and molecular weight and synthetic accessibility and improve LogP value and QED score of molecule CC(C[NH+](CC(=O)N[C@@H](c1cccs1)C1CC1)C[C@H]1Oc2ccccc2NC1=O)C(=O)[O-].
O=C(C[C@H]1Oc2ccccc2NC1=O)N[C@@H](c1cccs1)C1CC1
help me reduce molecular weight and rotatable bonds and synthetic accessibility of molecule CCC(CC)(CC)SC(C)(C)OC(=O)N1CC[C@H](N[C@@H](C)c2ccc(SC)cc2)C1.
CSc1ccc([C@H](C)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1
Help me reduce the number of hydrogen bond acceptors in molecule CC(C)(C#N)c1cccc(C(=O)N(c2cncc(N(Cl)c3cc(Br)cn3C3CC3)c2)c2ccccc2C(N)=O)c1Cl
CN(Cl)c1cncc(N(C(=O)c2cccc(C(C)(C)C#N)c2Cl)c2ccccc2C(N)=O)c1
help me reduce rotatable bonds and improve LogP value of molecule CC(C)C[NH+](CC(=O)[O-])[C@@H](F)C(=O)N[C@@H]1CN(C(=O)CC2CCC(C)(C)CC2)CC1(C)C.
CC1(C)CCC(CC(=O)N2C[C@@H](NC(=O)C(F)F)C(C)(C)C2)CC1
help me reduce LogP value and improve hydrogen bond acceptors and molecular weight and synthetic accessibility of molecule CC[C@@H](CC1CCCC1)C(=O)Nc1c(O)n[nH]c1-c1ccccc1.
CC[C@@H](C[NH+](CC1CCCC1)CC(C)C(=O)[O-])C(=O)Nc1c(O)n[nH]c1-c1ccccc1
help me reduce synthetic accessibility and improve QED score of molecule CCC(CC)(CC)SN(CC(=O)Nc1cc(Cl)ccc1OC)C(=O)C(C)(C)c1ccccc1.
COc1ccc(Cl)cc1NC(=O)CN(C)C(=O)C(C)(C)c1ccccc1
Help me make the molecule COc1cccc2c(=O)c(C(=O)Nc3nc(-c4ccc(Cl)cc4)cs3)c[nH]c12 with more hydrogen bond acceptors
O=C(Nc1nc(-c2ccc(Cl)cc2)cs1)c1c[nH]c2c(Oc3cc(Br)cn3C3CC3)cccc2c1=O
help me improve molecular weight and synthetic accessibility of molecule CN=C(NCC(C)Oc1ccc(OC)cc1)NC1CCN(CC(N)=O)CC1.
CCC(CC)(CC)SC(CNC(=NC)NC1CCN(CC(N)=O)CC1)Oc1ccc(OC)cc1
help me reduce LogP value and improve hydrogen bond acceptors and molecular weight and rotatable bonds of molecule O=C(NCc1cccc(Cl)c1)N[C@H]1CCCOc2cc(F)ccc21.
CC(C[NH+](CNC(=O)N[C@H]1CCCOc2cc(F)ccc21)Cc1cccc(Cl)c1)C(=O)[O-]
help me improve rotatable bonds and synthetic accessibility of molecule Cc1nn(C)cc1C(=O)C1=C(C(F)(F)F)Nc2ncnn2C1c1ccc(Cl)cc1.
Cc1nn(C)cc1C(=O)C1=C(C(F)(F)C[NH+](C)C2CC[NH+](C)CC2)Nc2ncnn2C1c1ccc(Cl)cc1
help me improve hydrogen bond acceptors and H-bond donors of molecule CCNC(=NCc1ccc(C)cc1OCC)NCC1(C)COC1.
CCNC(=NCc1ccc(B(O)O)cc1OCC)NCC1(C)COC1
Help me improve the QED of molecule CCCC(CCBr)C[C@@H](CNC(=O)[C@@H](C)Cc1ccc(C)cc1)N(C)Cc1nccs1 to make it more like a drug
Cc1ccc(C[C@H](C)C(=O)NC[C@H](C)N(C)Cc2nccs2)cc1
help me reduce LogP value and improve hydrogen bond acceptors and H-bond donors of molecule CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cn[nH]c3)[C@H]2C1)C1CC1.
CC(C)(C)OC(=O)NC(NC(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cn[nH]c3)[C@H]2C1)C(N)=O
Help me improve the QED of molecule CCC(NC(C)c1nc2sc3c(c2c(=O)[nH]1)CCC(C)C3)c1ccc(-c2csc(C(C)Cl)c2Cl)cc1 to make it more like a drug
CCC(NC(C)c1nc2sc3c(c2c(=O)[nH]1)CCC(C)C3)c1ccc(OC)cc1
help me reduce LogP value and QED score of molecule NS(=O)(=O)c1ccc(CNc2nc(C(F)(F)F)cc(=O)[nH]2)cc1.
NNC(=O)C(=O)NC(F)(F)c1cc(=O)[nH]c(NCc2ccc(S(N)(=O)=O)cc2)n1
help me improve hydrogen bond acceptors and H-bond donors of molecule CC(C)=CCCC1(C)C(CC=C(C)C)CC2(C)C(=O)C1(C(=O)c1ccccc1)C(=O)C1=C2OC(C(C)(C)O)C1O.
CC(=O)NCC(=O)NCC1(C)C(CC=C(C)C)CC2(C)C(=O)C1(C(=O)c1ccccc1)C(=O)C1=C2OC(C(C)(C)O)C1O
help me reduce LogP value and improve H-bond donors of molecule CC(=O)N1CCN(CC(=O)c2ccc3c(c2)OCCO3)CC1.
NC(=[NH2+])C(=O)N1CCN(CC(=O)c2ccc3c(c2)OCCO3)CC1
help me reduce rotatable bonds and improve QED score of molecule CC[Si](CC)(CC)CC(=O)c1cccc(Oc2nn(C)c(C(F)(F)F)c2Cl)c1.
Cn1nc(Oc2cccc(C(=O)CN)c2)c(Cl)c1C(F)(F)F
help me reduce LogP value and improve hydrogen bond acceptors of molecule Cc1cccc(-n2nc3c(c2NC(=O)c2cccs2)CS(=O)C3)c1C.
Cc1c(B(O)O)cccc1-n1nc2c(c1NC(=O)c1cccs1)CS(=O)C2
help me reduce rotatable bonds and synthetic accessibility of molecule CCC(C)CCC(C)c1ccc(-c2nc(C#N)c3[nH]c(=O)c(-c4ccc([N+](=O)[O-])cc4)cc3n2)cc1.
CCOc1ccc(-c2nc(C#N)c3[nH]c(=O)c(-c4ccc([N+](=O)[O-])cc4)cc3n2)cc1
help me improve hydrogen bond acceptors and H-bond donors of molecule Cc1coc(C)c1C(=O)N[C@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1.
Cc1coc(B(O)O)c1C(=O)N[C@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1
help me improve molecular weight and synthetic accessibility of molecule Cc1cc(C)c(NCC(=O)NCCc2cccc(Cl)c2)c(C)c1.
CCC(CC)(CC)Sc1cc(C)c(NCC(=O)NCCc2cccc(Cl)c2)c(C)c1
Help me make the molecule CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCc3ccccc3O2)CC1 with more hydrogen bond acceptors
C=CC(=CC=CO)OC(C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCc3ccccc3O2)CC1)C(C)NC(=O)OCC
help me reduce hydrogen bond acceptors and rotatable bonds and synthetic accessibility and improve LogP value and QED score of molecule CC(C[NH+](COc1cccnc1NC(=O)[C@H]1CCC[C@@H](O)C1)Cc1ccccc1)C(=O)[O-].
O=C(Nc1ncccc1OCc1ccccc1)[C@H]1CCC[C@@H](O)C1
help me reduce LogP value and improve molecular weight and rotatable bonds of molecule C[C@@H](c1ccccc1)N1CCC(NC(=O)NCc2ccco2)CC1.
CC(C[NH+](CNC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1)Cc1ccco1)C(=O)[O-]
Help me reduce the QED of molecule CCCCC(=O)N[C@@]1(C)CCN(C(=O)C2(c3ccccc3C)CC2)C1 to make it less like a drug
CCCCC(=O)N[C@@]1(C)CCN(C(=O)C2(c3ccccc3-c3ccc(Cl)c(Cl)c3)CC2)C1
Help me make the molecule CSCC[C@@H](O)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1F)C2 with more hydrogen bond acceptors
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCSSc3cccc(Cl)c3)C2)[C@@H](F)C1
Help me reduce the QED of molecule Cc1ccc([C@@H](C)N(C)C(=S)N[C@@H]2CCOc3ccccc32)cc1 to make it less like a drug
CCCCCCCCN(C(=S)N[C@@H]1CCOc2ccccc21)[C@H](C)c1ccc(C)cc1
help me reduce QED score and improve hydrogen bond acceptors and molecular weight and rotatable bonds of molecule C[C@@H]1CN(Cc2ccccc2F)C[C@H]1CNC(=O)C1CC2(CC2)C1.
CC(C[NH+](CNC(=O)C1CC2(CC2)C1)C[C@@H]1CN(Cc2ccccc2F)C[C@H]1C)C(=O)[O-]
help me improve hydrogen bond acceptors and H-bond donors of molecule Clc1ccn2ncc(CN3CCC[C@H](c4ccccn4)C3)c2n1.
NN=C(NN)c1ccn2ncc(CN3CCC[C@H](c4ccccn4)C3)c2n1
help me reduce synthetic accessibility and improve LogP value of molecule C[NH+]1CCN(C(=O)Cn2c(CNC(=O)CCCc3cccc(F)c3)nc3cccnc32)CC1.
O=C(CCCc1cccc(F)c1)NCc1nc2cccnc2n1CC1CC1
help me improve hydrogen bond acceptors and synthetic accessibility of molecule C[C@H](NC(=O)NC[C@H](CO)CC1CC1)c1cccc(OC(F)F)c1.
CC(C[NH+](CC1CC1)C[C@@H](CO)CNC(=O)N[C@@H](C)c1cccc(OC(F)F)c1)C(=O)[O-]
Help me make the molecule C=C(C=CC(=CC)c1c(OC)cc(Cn2c([C@H](C)NS(C)(=O)=O)nnc2N2CC[C@H](C)C2)cc1OC)C(C)CC with more hydrogen bond acceptors
COc1cc(Cn2c([C@H](C)NS(C)(=O)=O)nnc2N2CC[C@H](C)C2)cc(OC)c1OC
Help me make the molecule Cc1nc2cc(OCc3ccc(F)cc3)ccc2cc1C(=O)O with more hydrogen bond donors
O=C(O)c1cc2ccc(OCc3ccc(F)cc3)cc2nc1B(O)O
help me reduce molecular weight and rotatable bonds of molecule CC(C[NH+](COC(=O)C[C@H]1OCCc2ccccc21)Cc1ccc(F)cc1Cl)C(=O)[O-].
O=C(C[C@H]1OCCc2ccccc21)OCc1ccc(F)cc1Cl
help me reduce rotatable bonds and improve LogP value and QED score of molecule CC(C[NH+](Cc1cccc(Cl)c1)CC1(O)CCN(C(=O)CN2CC(=O)NC2=O)C1)C(=O)[O-].
O=C1CN(CC(=O)N2CCC(O)(Cc3cccc(Cl)c3)C2)C(=O)N1
Help me reduce the QED of molecule COc1cc(N2C[C@H](C(=O)O[C@H]3CCC[C@@H](C#N)C3)CC2=O)cc(OC)c1OC to make it less like a drug
C=C[C@@H](CCCCCCC)Oc1cc(N2C[C@H](C(=O)O[C@H]3CCC[C@@H](C#N)C3)CC2=O)cc(OC)c1OC
help me reduce QED score and improve rotatable bonds of molecule Cc1cc(C(=O)N2CCCCC2C)ccc1NC(=O)c1ccc(N2CCOC2=O)cc1.
CCCC(CCBr)CC1CCCCN1C(=O)c1ccc(NC(=O)c2ccc(N3CCOC3=O)cc2)c(C)c1
Help me reduce the number of hydrogen bond acceptors in molecule CN(C)CC(C)(C)CNC(=O)C1CCN(C(=O)COc2cccc(NC(=O)c3ccco3)c2)CC1
CC(C)C(C)C(C)CCC(C)(C)CNC(=O)C1CCN(C(=O)COc2cccc(NC(=O)c3ccco3)c2)CC1
Help me make the molecule Cc1nsc(N2CC[C@@H](NC(=O)c3ccccc3CC(C)C)C2)n1 with more hydrogen bond donors
CC(C)Cc1ccccc1C(=O)N[C@@H]1CCN(c2nc(B(O)O)ns2)C1
help me reduce H-bond donors and synthetic accessibility and improve LogP value of molecule CN(Cc1cccnc1)C(=O)CCn1c(C(N)=[NH2+])csc1=O.
Cc1csc(=O)n1CCC(=O)N(C)Cc1cccnc1
help me improve hydrogen bond acceptors and H-bond donors of molecule CC(C)NC(N)=NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1.
CC(C)NC(N)=NCc1cc([N+](=O)[O-])cc(C(F)(F)NC(=O)C(=O)NN)c1
help me improve molecular weight and synthetic accessibility of molecule COc1ccc(Cl)cc1C(=O)NCCn1ncccc1=O.
Cc1csc(Oc2ccc(Cl)cc2C(=O)NCCn2ncccc2=O)c1Cl
help me reduce LogP value and QED score of molecule CCO[C@H](CC)C(=O)N[C@H](C)CN(C)C(=O)c1ccsc1.
CCO[C@H](CC)C(=O)N[C@@H](CN(C)C(=O)c1ccsc1)C(N)=[NH2+]
Help me reduce the number of hydrogen bond acceptors in molecule C[C@@H](C[C@@H](C)CS(=O)(=O)NN(C)C)N[C@@H](C)c1nnc2ccccn12
CC(C)C[C@H](C)C[C@H](C)N[C@@H](C)c1nnc2ccccn12
Help me make the molecule COc1cc(C)cc(-c2noc([C@@H](NC(=O)c3ccccc3)C(C)C)n2)c1 with more hydrogen bond acceptors
CNCCNS(=O)(=O)[C@H](NC(=O)c1ccccc1)c1nc(-c2cc(C)cc(OC)c2)no1
help me reduce LogP value and QED score and improve synthetic accessibility of molecule C[C@@H](CNC(=O)NCc1ncn(C)n1)CN1CCOCC1.
CC(C[NH+](CNC(=O)NC[C@H](C)CN1CCOCC1)Cc1ncn(C)n1)C(=O)[O-]
help me reduce hydrogen bond acceptors and rotatable bonds and synthetic accessibility of molecule CC(C[NH+](CNC(=O)c1cnn2c(-c3ccccc3Cl)ccnc12)Cc1ccc(F)cc1)C(=O)[O-].
O=C(NCc1ccc(F)cc1)c1cnn2c(-c3ccccc3Cl)ccnc12
help me reduce QED score and improve rotatable bonds of molecule COc1ccc(-n2cnnn2)cc1C(=O)N1CCC(CCO)(c2ccc(C)c(C)c2)C1.
COc1ccc(-n2cnnn2)cc1C(=O)N1CCC(CCC(C)=CCCBr)(c2ccc(C)c(C)c2)C1
help me improve molecular weight and rotatable bonds and synthetic accessibility of molecule Cc1c(C(=O)N(C)C[C@@H]2CCN2CC2CC2)oc2c(F)cccc12.
CCC(CC)(CC)Sc1c(C(=O)N(C)C[C@@H]2CCN2CC2CC2)oc2c(F)cccc12
Help me reduce the number of hydrogen bond donors in molecule C[C@@H](O)CN1CC[C@@H](NC(=O)c2cn(C)c(B(O)O)cc2=O)C1
Cc1cc(=O)c(C(=O)N[C@@H]2CCN(C[C@@H](C)O)C2)cn1C
help me reduce molecular weight and rotatable bonds and synthetic accessibility and improve QED score of molecule CCC(CC)(CC)Sc1ccc(N2C[C@H](C(=O)NCc3ccoc3)CC2=O)cc1F.
Cc1ccc(N2C[C@H](C(=O)NCc3ccoc3)CC2=O)cc1F
help me reduce LogP value and improve H-bond donors of molecule CC(C)(C)OC(=O)N1CCC(N(C(=O)c2ccc(-c3ccc(C(N)=O)cc3)cc2)C2CC2)CC1.
CC(C)(C)OC(=O)N1CCC(N(C(=O)c2cc(C(N)=[NH+]O)ccc2-c2ccc(C(N)=O)cc2)C2CC2)CC1
Help me reduce the number of hydrogen bond donors in molecule CCCCCC(Cc1nc(-c2cccc(O)n2)no1)C(N)=[NH2+]
CCCCC[C@@H](C)Cc1nc(-c2cccc(O)n2)no1
help me reduce LogP value and improve hydrogen bond acceptors and rotatable bonds of molecule C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NC12CCC(CC1)C2.
CC(C)C[NH+](CC(=O)[O-])C(F)(F)c1ccc(C[C@@H](C)C(=O)NC23CCC(CC2)C3)cc1
help me reduce QED score and improve hydrogen bond acceptors of molecule CCN(CCCF)[C@H](C)CNC(=O)c1nc2c(s1)CCC2.
CCN(CCCNC(=O)C(=O)NN)[C@H](C)CNC(=O)c1nc2c(s1)CCC2
help me reduce LogP value and improve hydrogen bond acceptors and rotatable bonds and synthetic accessibility of molecule Cn1c(=O)ccc2c(NC(=O)NC3CC(C)(C(F)F)Oc4ccccc43)cccc21.
CC(C)C[NH+](CC(=O)[O-])[C@@H](F)C1(C)CC(NC(=O)Nc2cccc3c2ccc(=O)n3C)c2ccccc2O1
help me reduce LogP value and QED score and improve hydrogen bond acceptors and molecular weight of molecule CCc1ncc(CNC(=O)NC[C@@H]2C[C@@H]2C2CCOCC2)o1.
CCc1ncc(C[NH+](CNC(=O)NC[C@@H]2C[C@@H]2C2CCOCC2)CC(C)C(=O)[O-])o1
help me improve molecular weight and rotatable bonds of molecule CN=C(NCC(=O)Nc1ccc(F)cc1)N1CCC2(CCCC2)C1.
CC1CCC(CCN=C(NCC(=O)Nc2ccc(F)cc2)N2CCC3(CCCC3)C2)CC1
help me reduce hydrogen bond acceptors and synthetic accessibility of molecule CCCCC[C@H]1CCCN1C(=O)CNC(=O)NC[NH+](Cc1ccc(F)cc1)CC(C)C(=O)[O-].
CCCCC[C@H]1CCCN1C(=O)CNC(=O)NCc1ccc(F)cc1
Help me reduce the QED of molecule NCC1CCC(n2cnc3cnc4c(ccn4S(=O)(=O)c4ccccc4)c32)CC1 to make it less like a drug
CC(NCC1CCC(n2cnc3cnc4c(ccn4S(=O)(=O)c4ccccc4)c32)CC1)c1ccc(Cl)cc1
Help me improve the QED of molecule CCOc1ccccc1OCCn1c(=O)[nH]c2sc(C(N)=[NH2+])cc2c1=O to make it more like a drug
CCOc1ccccc1OCCn1c(=O)[nH]c2sc(C)cc2c1=O
Help me make the molecule CCC(CC)CC(C)CCC(=O)c1cc2cc(-c3ccnc(C(=O)CCc4ccncc4)c3)ccc2[nH]1 with more hydrogen bond acceptors
COCC(=O)c1cc2cc(-c3ccnc(C(=O)CCc4ccncc4)c3)ccc2[nH]1
help me reduce LogP value and improve rotatable bonds and synthetic accessibility of molecule COc1cc(Cl)ccc1CC(=O)N1C[C@H]2COC[C@@H](C1)[C@H]2NC(=O)C1(Br)CC1.
COc1cc(Cl)ccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C([NH3+])C1(C[NH2+]Br)CC1
help me reduce LogP value and improve synthetic accessibility of molecule C#CC1(CCC(C)=O)COC(C)(C)O1.
C#CC1(CCC(=O)C(N)=[NH2+])COC(C)(C)O1
Help me reduce the number of hydrogen bond donors in molecule CCOC(=O)C(CCC(=O)O)NC(=O)C(N)Cc1ccccc1
CCOC(=O)C(CCC(=O)O)NC(=O)C(CC(F)=C(F)F)Cc1ccccc1
help me improve hydrogen bond acceptors and H-bond donors of molecule Cc1cc(N)cc(C)c1S(=O)(=O)NCCC(C)S(C)=O.
Cc1cc(N)cc(B(O)O)c1S(=O)(=O)NCCC(C)S(C)=O
Help me reduce the QED of molecule COc1cccc(C(=O)CN2CCN(CC(C)C)CC2)c1 to make it less like a drug
CCCCCCC(CN1CCN(CC(=O)c2cccc(OC)c2)CC1)C(C)C
Help me make the molecule CCCC(CC(F)=C(F)F)NC(=O)C1CCCN1C(=O)C1CCC(=O)N1 with more hydrogen bond acceptors
CCCC(N)NC(=O)C1CCCN1C(=O)C1CCC(=O)N1
Help me improve the QED of molecule CCCCCCCCC(=O)OC1CCC(CCNS(=O)(=O)c2ccc(Cl)cc2)CC1 to make it more like a drug
CC(=O)OC1CCC(CCNS(=O)(=O)c2ccc(Cl)cc2)CC1
help me reduce QED score and improve rotatable bonds and synthetic accessibility of molecule Cc1cc(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)on1.
CCC(CC)(CC)SN(C(=O)c1cc(C)no1)C1CCN(Cc2ccccc2)CC1
Help me reduce the QED of molecule Cc1ccc(S(=O)(=O)N2CCC(N3C(=O)c4ccccc4C3=O)C2)s1 to make it less like a drug
CCCCCCCCc1ccc(S(=O)(=O)N2CCC(N3C(=O)c4ccccc4C3=O)C2)s1
Help me make the molecule NC(=[NH2+])N(Cc1ccc(Sc2ccccn2)o1)[C@H]1CCNC1=O with more hydrogen bond acceptors
CN(Cc1ccc(Sc2ccccn2)o1)[C@H]1CCNC1=O
help me reduce hydrogen bond acceptors and improve QED score of molecule CN(C)C(=O)CCOc1ccc(C(=O)O)cc1C(F)(F)NC(=O)C(=O)NN.
CN(C)C(=O)CCOc1ccc(C(=O)O)cc1C(F)(F)F
End of preview. Expand in Data Studio
README.md exists but content is empty.
Downloads last month
4