Added 275 molecules from epoch 16741 for P31645
Browse files- P31645_molecules.csv +275 -0
P31645_molecules.csv
CHANGED
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@@ -40953,3 +40953,278 @@ rxn:2:68371:138960,COc1ccc(C2(N3CCC(NCc4nc(C5CCCSCC5)no4)CC3)CC2)cc1,GRIZYKKVLHL
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| 40953 |
rxn:2:78065:140172,COc1nc(N2CCCC2)ccc1C(C)NCCCCN1CCSCC1,HGBUVDVIGQCMKM-UHFFFAOYSA-N
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| 40954 |
rxn:2:80849:138163,COc1cc(C)c(NC2CCN(CC3CCCCN3C)C(C)C2)c(C)n1,WMESUTYQMATAMI-UHFFFAOYSA-N
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| 40955 |
rxn:2:91426:96572,COc1nc2c(cc1NC(C)CCCCN1CCSCC1)CCN(C)CC2,HQLIQBDYIVUZSB-UHFFFAOYSA-N
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| 40953 |
rxn:2:78065:140172,COc1nc(N2CCCC2)ccc1C(C)NCCCCN1CCSCC1,HGBUVDVIGQCMKM-UHFFFAOYSA-N
|
| 40954 |
rxn:2:80849:138163,COc1cc(C)c(NC2CCN(CC3CCCCN3C)C(C)C2)c(C)n1,WMESUTYQMATAMI-UHFFFAOYSA-N
|
| 40955 |
rxn:2:91426:96572,COc1nc2c(cc1NC(C)CCCCN1CCSCC1)CCN(C)CC2,HQLIQBDYIVUZSB-UHFFFAOYSA-N
|
| 40956 |
+
008472AECC3717E8_9547280AD08227F1_6028_UN,C1C2CC1N(CC3=C2C=CC=C3)[S](C4=CC(=C(OC)C=C4)Br)(=O)=O,UFLRMTWPGJVVEX-UHFFFAOYSA-N
|
| 40957 |
+
01FEBDB51A5684F0_ED2789FF9371252E_6041_UN,FC1=C(C=CC(=C1)C2OCCO2)NC3=CC(=C(N(C)C)C=C3)F,MXJIHUXIKBYFEF-UHFFFAOYSA-N
|
| 40958 |
+
04EF5B3B35BC24AD_E207AD65FE18F4E3_6041_DP,O=[N](=O)C2=C1N=C(C=CC1=CC(=C2)F)NC3CCNC34CCC4,MDOWQAUCCQRIOF-UHFFFAOYSA-N
|
| 40959 |
+
055632DE89340DC2_4A6970460A0F15ED_6026_UN,COC1=C(C=C(C(=C1)[S](=O)(=O)NC4=C3C2=C(CCC2=CC=C3)C=C4)OC)Br,IUEVCVBBIDRWBG-UHFFFAOYSA-N
|
| 40960 |
+
08C79CB42D7B5C48_E1BF3CB8D860B2E5_6039_DP,COCCC4(COCC1OCCC12CCNCC2)CC3OC3C4,FWTDXWXIWJBNQW-UHFFFAOYSA-N
|
| 40961 |
+
09AAB8608A154E8A_5CCAA63224AC93BF_6004_UN,NC(=O)C1=C(C=C(C(=C1)[S](=O)(=O)Cl)C2=CC3=C(C=C2)CC4=C3C=CC=C4)F,XLKQJPCWTIZJPS-UHFFFAOYSA-N
|
| 40962 |
+
0AF32EBBBA7F2D23_54A187D6A1B33CF3_6041_UN,C2(=C1OCCOC1=CC(=C2)CC#N)NC3=C[N](=CC=C3)=O,OIVPPSOERLOVBP-UHFFFAOYSA-N
|
| 40963 |
+
0B36980A96A34D54_95C06FD52BDD6337_7022_DP,C[Si](C)(C)C1=CC=C(C=C1)NCC2CC3(CN2)CCC3,PXHWGIQZWKNETO-UHFFFAOYSA-N
|
| 40964 |
+
0C2D43CB81C7AF6B_FB797D13C4208027_6041_UN,CC1=C(C=CC(=C1)NCC2=C(CC)C=CC3=C2C=CC=C3)[N](=O)=O,BKYPQJDKQLYUDU-UHFFFAOYSA-N
|
| 40965 |
+
0E13C3D3E95EB215_C5E262E7EE4E74D4_6039_UN,CC(OCC2COC1(CCCC1)O2)C3=CC4=C(C=C3)OCO4,YGSWJAOBJRUKBS-UHFFFAOYSA-N
|
| 40966 |
+
10483FEDC0745B67_A6C724D80A75561F_6026_UN,CCCC1=C(C=CC=C1)[S](=O)(=O)NC2=CC(=C(C=C2)Cl)CN(C)C,UTESKIVEAQOZSW-UHFFFAOYSA-N
|
| 40967 |
+
10AF2DBA20B55545_448FB2037518F755_7022_UN,C1(=CC(=C(C=C1)F)[N](=O)=O)NCC2=CC3=C(C=C2)N=CC=C3,LRTKKNDDPDWLSR-UHFFFAOYSA-N
|
| 40968 |
+
121089269509F4BD_273C2F34E9F27776_6034_UN,COC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)CCC4(N)COC4,JOWKMWIYHMNQHV-UHFFFAOYSA-N
|
| 40969 |
+
1318EDE9C4589065_BF3EF68E9C5E7397_7019_UN,ClC1=CC3=C(C(=C1)C=CCC2(C)OCCO2)C=CC=C3,MDYAKJDELSXCFU-UHFFFAOYSA-N
|
| 40970 |
+
14E06DBB7141D0BA_C2F93BBA3688C046_6041_UN,CCOC1=C(C=C(C=C1)[N](=O)=O)NCC2=CC(=C(C=C2)F)COC3=CC=CC(=C3)OC,URJVEIZTQHVBCB-UHFFFAOYSA-N
|
| 40971 |
+
158745DDA864BBBA_7CB310A4A4384418_6041_UN,CN(C)P(N(C)C)C1=CC=C(C=C1)NCC2CCCCN(C)C2,NWKDHRQLBVMALX-UHFFFAOYSA-N
|
| 40972 |
+
15B6C9FB8A99149F_339004FED47164E2_6026_UN,COC1=C(C(=CC=C1)[S](=O)(=O)NC2=CC4=C(C=C2)OC3(CCC3)C=C4)OC,OKDLNERPEMXAJG-UHFFFAOYSA-N
|
| 40973 |
+
184303B13E839A66_8932D0DCD7E66E31_7019_DP,O=[N](=O)C1=CC4=C(C(=C1)C=CC2CNCC3=C2C=CC=C3)OCOC4,JWTMENDDUJQGOI-UHFFFAOYSA-N
|
| 40974 |
+
190F101A94B860AF_7B5AA7418E5E5FAA_6035_UN,O(CCC1NCCNC1)C2=C(OC)C=C(C=C2CC=C)C,PGCWJYIXPNCYJO-UHFFFAOYSA-N
|
| 40975 |
+
1BA7952E7D40CE1B_0E205CB86ECF5D9E_6039_DP,COCC4(COCC2OCC1(CNC1)C2)CC3OC3C4,GRGWTHXVGRRDLD-UHFFFAOYSA-N
|
| 40976 |
+
1BDE8D929F381F60_5D14549C7C27C1CE_6041_DP,C[Si](C)(C)C#CC1=CC(=CC=C1)NCC3C2CCC2CN3,FGBYVHLPYFXQOC-UHFFFAOYSA-N
|
| 40977 |
+
1BE5A2D57ED89291_0CC12C72BFCDEACF_6026_DP,[S](=O)(=O)(C1=CC2=C(C=C1)C=C(N=[N]#N)C=C2)NC3C4(NCC3)CC4,WDRIPYITQGZCON-UHFFFAOYSA-N
|
| 40978 |
+
1BE5D88F8EE119CA_588BA5487BA2ECC6_6034_UN,BrC1=CC2=C(C=C1)N(C(=O)O2)C[C@H]4CC3=C(C=CC=C3)CN4,FPAHTHBXOKLBFB-CQSZACIVSA-N
|
| 40979 |
+
1E09F7830149761A_BB7EA7F9AF93EF0C_7022_DP,C2(=C1C=CC=CC1=C(C=C2)Cl)N[C@@]34CCN[C@@H]3CCC4,JLNQHJXVAZCCOK-SJORKVTESA-N
|
| 40980 |
+
1F625772C413024C_A274204D3690176D_6038_UN,COC1=CC(=C(C=C1)N[S](=O)(=O)C)NC(=O)C4=CC3=C(C=C2OCCOC2=C3)[NH]4,GKJNAIOUQMYJQX-UHFFFAOYSA-N
|
| 40981 |
+
2004AC04437B0EF0_03CBB4AEB40B34E4_6038_UN,N(C2=C1C3CCC(C1=CC=C2)O3)C(C4=C(OC)C=CC(=C4F)Br)=O,ILKBFSLBLUGDIX-UHFFFAOYSA-N
|
| 40982 |
+
210A88E8514401D5_C70759D58B178323_6026_UN,COC1=C(C=C(C(=C1)[S](=O)(=O)NC4=C3C2=C(CCC2=CC=C3)C=C4)OC)Cl,GIMCUWOROPURAT-UHFFFAOYSA-N
|
| 40983 |
+
2254E49F62D6FDDF_1595F5B84D24F47C_6028_UN,N(CCC1CC2CCC1C2)[S](C3=C(C=C(F)C=C3)Br)(=O)=O,WUTRMPKQOCIDFN-UHFFFAOYSA-N
|
| 40984 |
+
22F564433905812E_9A2370F48C60DBEE_6027_DP,N3CC4(N[S](C[C@@]12CC[C@@H](C1(C)C)CC2=O)(=O)=O)CC3C4,ZGBMUHIQQVMLHH-ZGBLGHFFSA-N
|
| 40985 |
+
22F564433905812E_9A2370F48C60DBEE_7015_DP,N3CC4(N[S](C[C@@]12CC[C@@H](C1(C)C)CC2=O)(=O)=O)CC3C4,ZGBMUHIQQVMLHH-ZGBLGHFFSA-N
|
| 40986 |
+
2413D627EBB0D48C_CD8459152C8F2A3B_6041_UN,C1(=CC=C(C=C1)OC2CCC2)NC3=CC(=CC(=C3)F)N(C)C,VJNWWRJHSMZQQM-UHFFFAOYSA-N
|
| 40987 |
+
25BE0CE0AB29906E_7E8D303A6D7D63B2_6035_DP,N3CC1=C(C=C(C=C1)COC2=CC(=C(C=C2)F)[S](C)(=O)=O)C3,PVBMKIUBDXFWCV-UHFFFAOYSA-N
|
| 40988 |
+
25DE801A6E6B9522_8DBAD26AAFA28C2E_6038_UN,N(CCC1=CC=C(C=C1)[S](=O)(=O)N)C(C2=CSC3=C2C=CC(=C3)OC)=O,RTIIXQCWEUTDQL-UHFFFAOYSA-N
|
| 40989 |
+
286FDF0BB4E148CB_01D615602FB1E975_6041_UN,C1(=NC=C(S1)C2OCCO2)NC3=CC(=CC(=C3)F)N(C)C,DWIUWQKFAZYCLV-UHFFFAOYSA-N
|
| 40990 |
+
28B6C4575EB49888_7C12C27D95D19879_6029_UN,C1C3CC4CC(N1[S](C2=CC(=C(C=C2)I)F)(=O)=O)C3C4,VBTMYZJSYDFUOZ-UHFFFAOYSA-N
|
| 40991 |
+
2B86C661D648F04A_1D892EF9BEC93DE1_6034_UN,IC1=CC2=C(C=C1)N(C(=O)O2)C[C@H]4CC3=C(C=CC=C3)CN4,MKOYUWLFUJNZAA-CQSZACIVSA-N
|
| 40992 |
+
2CA85F7E35A797D7_F7176DBE4664F9D6_6029_UN,C1C3CC4CC(N1[S](C2=C(C=C(C)C=C2O)Cl)(=O)=O)C3C4,UFQZCNOJXCYMNE-UHFFFAOYSA-N
|
| 40993 |
+
2F2DEA1966F22780_B1AAE0187C75835C_6031_DP,O(C(=O)C[C@H]1NCC2=C(C1)C=CC=C2)CC3CNCC4=C3C=CC=C4,PLDWDBXNAYAMBV-GGYWPGCISA-N
|
| 40994 |
+
30E90606D7CA8C8F_3581E85C6C812F38_6026_DP,O=[N](=O)C1=C(C=CC(=C1)F)[S](=O)(=O)NC4=CC2=C(C3NC2CC3)C=C4,TZGXASXYEUHWMP-UHFFFAOYSA-N
|
| 40995 |
+
31FFA9BA860D912E_50B0F8B9A5B59E59_6035_UN,COC1(CC3(C1)CNCC(OC2=C(C(N)=N)C=C(C=C2)Cl)C3)OC,ATQGBYOOOUSAJY-UHFFFAOYSA-N
|
| 40996 |
+
3257553391AE7136_005A8F72260D66C1_6029_UN,C1C3CC(N1[S](C2=CC=C(C(=C2Cl)CO)F)(=O)=O)C4=C3C=CC=C4,IAICQRTXVWLMLI-UHFFFAOYSA-N
|
| 40997 |
+
3377D95A8E6219A3_A4703D372D47121F_7019_UN,C(C1=CC2=C(C=C1)CCOC2)=CC3=CC(=CC(=C3O)O)Cl,DQDRAMFIGDLNIH-UHFFFAOYSA-N
|
| 40998 |
+
344676412434A01A_4772FDEEED75861B_6035_UN,CCOC4CC(OC1=C(C=CC=C1C2CCCCC2)C3CCCCC3)C45CCOCC5,HWJGPLVHNXSYBR-UHFFFAOYSA-N
|
| 40999 |
+
36397F1F0C53945C_7147B98EDA080983_7017_UN,N2([S](=O)(=O)C1=CC(=C(C=C1)C#N)Br)C3CCC2CNC3,IBDFYJGVWIVCQU-UHFFFAOYSA-N
|
| 41000 |
+
3693E425F875F93A_755B949BC8F7620D_6041_UN,C1(=CC2=C(C=C1)C=C[NH]2)NC3=CC(=CC(=C3)F)N4CCCC4,NYPACVUEDSYMAQ-UHFFFAOYSA-N
|
| 41001 |
+
3693E425F875F93A_989334E5B5DC0BE0_6041_UN,C1(=CC2=C(C=C1)C=C[NH]2)NC3=CC(=CC(=C3)F)N4CCCC4,NYPACVUEDSYMAQ-UHFFFAOYSA-N
|
| 41002 |
+
369EC25562C36F22_81F5CA7AE4F1B78D_6034_DP,N1CCC(=CC1)N2C(=O)N(C3=C2C=CC=C3)CC4=C(C=CC(=C4)N)F,QTJVCZCUJOJUGW-UHFFFAOYSA-N
|
| 41003 |
+
374169179F3BBC51_F27F3F1C477E7F11_6041_UN,C[S](=O)(=O)OCC1=C(C=CC(=C1)F)NC3=CC(=C(OC2=CC=CC(=C2)OC)C=C3)F,QOZPELQYPJRVQT-UHFFFAOYSA-N
|
| 41004 |
+
3746D5EF86A75EA1_D3E3C77E6D5D8E42_6039_UN,O(CC1(CCCO1)C2CCCO2)CCC3OCCC3C,FEYHGHKFPXDVDJ-UHFFFAOYSA-N
|
| 41005 |
+
37EE295CE418FBE7_A31136422C8F0BA7_6041_UN,FC1(CCOCC1)C2=CC=C(C=C2)NC3=CC=CC(=C3)CSC,UFEGJDMHGNAHFB-UHFFFAOYSA-N
|
| 41006 |
+
3AD5DEDD2A533E40_BEBEF516ADCD25A3_6039_DP,COCCC4(COCC1OCCC12CNC2)CC3OC3C4,LVYQLBTZGZCXCA-UHFFFAOYSA-N
|
| 41007 |
+
3AEB262A9D171FE5_81BE62F476D7B5D0_6026_UN,C[N]1C=C(Br)C2=C1C=C(C=C2)[S](=O)(=O)NC4=C(C=C(OC3=CC=CC(=C3)OC)C=C4)C,OFNOJSSMMMSKRB-UHFFFAOYSA-N
|
| 41008 |
+
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| 41170 |
+
EF4313B6C5769A23_D5C696F0A81D1131_6026_UN,[S](=O)(=O)(C1=C[NH]C2=C1C=CC(=C2)Br)NC4(CC3=CC=C(C=C3)F)CCCCC4,PERVUXKXKXMLBY-UHFFFAOYSA-N
|
| 41171 |
+
EF5D58D3AD7A7E54_E76731C90D4E23DC_6026_UN,CC1=C(C(=CC=C1)[S](=O)(=O)N2C4CCC2CC3(CC3(F)F)C4)F,CQFJJZGJARDXKT-UHFFFAOYSA-N
|
| 41172 |
+
F071DCDA1E1BCB52_9C6AF8EC2B67A4B5_6026_UN,[S](=O)(=O)(C1=CC2=C(C=C1)OCO2)NC4(C3=C(OC)C=CC(=C3)Br)CC4,HDXOONGIEVICGO-UHFFFAOYSA-N
|
| 41173 |
+
F37682CED02FFBE5_49EDC6DACF624918_6026_UN,[S](=O)(=O)(C1=CC2=C(C=C1)C3=C(O2)C=CC=C3)NC5(CC4=C(OC)C=CC(=C4)F)CC5,QHJHJXAJCBQOMF-UHFFFAOYSA-N
|
| 41174 |
+
F45A3135FDB565DB_980F1200C2619DB7_6035_DP,C[C@]3(COC2=CC1=C(CCNCC1)C=C2)COC[C@H]4CCCN34,TWSHSJUQHFUYMB-IEBWSBKVSA-N
|
| 41175 |
+
F66486503B52A942_9C61DF259ED4C11D_6029_UN,C1C3CC(N1[S](C2=C(C)C=CC=C2CBr)(=O)=O)C=CC3,GRGDFZMIGWXXNF-UHFFFAOYSA-N
|
| 41176 |
+
F9367A82D73AF1E1_48B2E2E286E70ABD_7022_DP,C[Si](C)(C)C1=CC(=CC=C1)NCC3C2CCCCC2NC3,GGAGFNBSZQPSRB-UHFFFAOYSA-N
|
| 41177 |
+
F99FF9040DAFC713_A23ECB1E0B4DA3EF_6041_UN,CN(C)P(N(C)C)C1=CC(=CC=C1)NC3=C2OCCC2=CC=C3,BKPNEOBCAQRDOC-UHFFFAOYSA-N
|
| 41178 |
+
FB0069D60C48A177_3A5D0FA0D4052694_6028_UN,N(CCC1CC2CCC1C2)[S](C3=C(C=C(F)C=C3)F)(=O)=O,YOAXVFBKWZDPGP-UHFFFAOYSA-N
|
| 41179 |
+
FB39C0AFAE4EE429_957BE59C99A54189_7005_UN,N4=C(C1=C(C=N[N]1C)C2CC2)[NH]C5=CC3=C(OCCCO3)C=C45,AGOVRIKPRKVGGS-UHFFFAOYSA-N
|
| 41180 |
+
FB6539C75351DFC6_869DEF885E680DAB_6031_DP,N2CC[N]1C(=CC=C1C2)C(=O)OCC3=CC4=C(C=C3)OC=C4,GREDPZVBAIINHP-UHFFFAOYSA-N
|
| 41181 |
+
FBE38F1E4E6F602D_8F0480E50FFEE552_6026_UN,[S](=O)(=O)(C1=C(C2=C(C=C1)C=CC=C2)Br)NC4(C3=C(OC)C=CC(=C3)Br)CC4,OAGGTLWIOWWFPA-UHFFFAOYSA-N
|
| 41182 |
+
FD3A478288C3AC43_2654AFC8D2BD8A2F_6041_DP,CC(=O)[C@@H]1C[C@H]1C2=C(C=C(C=C2)NC3CCNC34CCCC4)F,ONDSXMBNAYNLIN-MZQXSQAVSA-N
|
| 41183 |
+
FE9180B7C7378866_9BD2E6C72D9DF618_6038_UN,N(C1C2=C(SCC1)C=CC(=C2)F)C(=O)C4=C3N=CC=CC3=C(C=C4)F,OEUYLPWAAYRZNH-UHFFFAOYSA-N
|
| 41184 |
+
rxn:2:103033:109488,CCC(Nc1cc(CN(C)C)nn1C)C1CCCN(C2CCCCC2)C1,QFZPJSZJTTULFM-UHFFFAOYSA-N
|
| 41185 |
+
rxn:2:103033:112206,CCC(Nc1cc(CN(C)C)nn1C)C1CCN(C2CCCCC2)CC1,KBOMITRILPDUSI-UHFFFAOYSA-N
|
| 41186 |
+
rxn:2:103033:135534,CCC(Nc1cc(CN(C)C)nn1C)C1CCN(C2CCCC2)CC1,KSQMNSUEGTYEJQ-UHFFFAOYSA-N
|
| 41187 |
+
rxn:2:107060:122653,COc1ccccc1C(NCCC1CCC(c2ccc3c(c2)OCO3)CC1)C1CCCO1,XQTJFDGFZXGPCF-UHFFFAOYSA-N
|
| 41188 |
+
rxn:2:109629:120599,CC1(C)CCC(CCNC2CCCCC2CC2CCC2)c2ccccc21,QOOLNBAEIWFAHM-UHFFFAOYSA-N
|
| 41189 |
+
rxn:2:110745:135102,COc1cc2c(c(OC)c1C(C)NCC1(N3CCCC3)COC1)OCO2,JPAAKCFBSPVPJW-UHFFFAOYSA-N
|
| 41190 |
+
rxn:2:114879:135102,COc1cc2c(c(OC)c1C(C)NCC1(N3CCOCC3)CC1)OCO2,RSTULZBULKHSIS-UHFFFAOYSA-N
|
| 41191 |
+
rxn:2:118748:170161,COc1ccc2cc(C3CC(C)CC(NCCN4CCOCC5CCCCC54)C3)ccc2c1,ZTNVUMWRZPNGKS-UHFFFAOYSA-N
|
| 41192 |
+
rxn:2:120668:133317,COCC(CC1CCOCC1)NCCCN1CC2COCC2C1,PIPIWQGQVDOUFE-UHFFFAOYSA-N
|
| 41193 |
+
rxn:2:123060:133359,CSC1CCC(NCCN(C)C2CCCCC2N(C)C)C1,FEQUWUUZIVDJRK-UHFFFAOYSA-N
|
| 41194 |
+
rxn:2:124213:170161,COc1ccc2cc(C3CC(C)CC(NCCC4CCOC5(COC5)C4)C3)ccc2c1,OBKGNNOTQLZYOG-UHFFFAOYSA-N
|
| 41195 |
+
rxn:2:126244:148172,CCN1CC2CC1CCC2CNC1c2cccc(OC)c2S(=O)(=O)CC1C,MWMCGASZONUBOV-UHFFFAOYSA-N
|
| 41196 |
+
rxn:2:126592:147636,CCC(CNC1c2cccc(OC)c2OCCC1CN1CCOCC1)N1CCCCC1,DBYCOJZPJDULAP-UHFFFAOYSA-N
|
| 41197 |
+
rxn:2:127548:70570,COc1cccc2c1C(NCC(C)CCN1CCN3CCCCC3C1)COC2,DKOLCENYTMBXSM-UHFFFAOYSA-N
|
| 41198 |
+
rxn:2:133317:132215,COCC(CC1CCOCC1)NCCCN1CCC2COCC2C1,PJOIZJAGGVCHDQ-UHFFFAOYSA-N
|
| 41199 |
+
rxn:2:133359:123060,CSC1CCC(NCCN(C)C2CCCCC2N(C)C)C1,FEQUWUUZIVDJRK-UHFFFAOYSA-N
|
| 41200 |
+
rxn:2:68613:130782,COc1ccccc1CC(CC1CCCC1)NCCC1COC2(CCC2)CO1,POQWAUYBTXYCBM-UHFFFAOYSA-N
|
| 41201 |
+
rxn:2:68909:127077,COCC12COC(CNC3CCC(c4ccc5c(c4)OCO5)CC3)(C1)C2,CAGQTDOTITZYON-UHFFFAOYSA-N
|
| 41202 |
+
rxn:2:69184:89398,C[Si](C)(C)C1CC(NCc2cccc(COC3CCOC3)n2)C12CCC2,OPXZNWXKBNZBHZ-UHFFFAOYSA-N
|
| 41203 |
+
rxn:2:70234:129456,COc1ccc2c(c1)CCN1CCC(NCCCC(C)N3CCCOCC3)CC21,VECSNNWBMCYBJX-UHFFFAOYSA-N
|
| 41204 |
+
rxn:2:70234:90102,COc1cccc2c1SCCC(NCCCC(C)N1CCCOCC1)C2,NIFQWVUMKQOGIQ-UHFFFAOYSA-N
|
| 41205 |
+
rxn:2:70570:127548,COc1cccc2c1C(NCC(C)CCN1CCN3CCCCC3C1)COC2,DKOLCENYTMBXSM-UHFFFAOYSA-N
|
| 41206 |
+
rxn:2:70600:91293,COc1ccc(C(C)NCCCOC2COC2)cc1CN1CCCCCC1,ZJDVOKUPRPSGKQ-UHFFFAOYSA-N
|
| 41207 |
+
rxn:2:70618:139821,COCC1(CCNC2CCCCC2CN2CCOC3CCCC32)CCOCC1,OUBPOKFMUQJATL-UHFFFAOYSA-N
|
| 41208 |
+
rxn:2:70618:94795,COCC1(CCNC2CCCC2CN2CCOC3CCCCC32)CCOCC1,BPWUBGPKWNLEFE-UHFFFAOYSA-N
|
| 41209 |
+
rxn:2:70820:132617,C[Si](C)(C)c1ccc(C2CC2CCNCC2CCCCN2CC2CC2)cc1,CLVFZIBDGBHZKR-UHFFFAOYSA-N
|
| 41210 |
+
rxn:2:77965:156415,COc1ccc2cc(C(CC3=NCCO3)NCC34COCCN3CCOC4)ccc2c1,GTMDCQYXHMXIFQ-UHFFFAOYSA-N
|
| 41211 |
+
rxn:2:78620:171550,COC1(CNC2CCC(c3ccc(-c4cccc5c4OCO5)cc3)CC2)COCCOC1,LHPMHJHXTPQBRS-UHFFFAOYSA-N
|
| 41212 |
+
rxn:2:79350:116020,COCC(CC1CCOCC1)NC(C)c1ccccc1OCC1CCCO1,CFLNTNAMYPPOKM-UHFFFAOYSA-N
|
| 41213 |
+
rxn:2:83816:134293,COC(CNCC#Cc1cc(C)ccc1OCC1CCOC1)C1CCOC1,BDBNJNDJEIXSAS-UHFFFAOYSA-N
|
| 41214 |
+
rxn:2:84473:101800,COc1cc(C2CC2CCNC2CCN(C3CCC3)C(C)C2)cc2c1OCO2,UFCOZMLHCHACFL-UHFFFAOYSA-N
|
| 41215 |
+
rxn:2:86915:109105,COc1cc2occc2cc1C(C)NCC1CCC(C)CC1OCC1CCCO1,YRIIPZFETNDYRR-UHFFFAOYSA-N
|
| 41216 |
+
rxn:2:86915:95668,COc1cc2occc2cc1C(C)NCC1CCC(COC2CCCCC2C)O1,CHTQXLAULGGEHI-UHFFFAOYSA-N
|
| 41217 |
+
rxn:2:89237:108419,CC1(CCCNCC2CCCCN2C2CCCCC2)CC1,KFLITHYTLJBYOU-UHFFFAOYSA-N
|
| 41218 |
+
rxn:2:89398:69184,C[Si](C)(C)C1CC(NCc2cccc(COC3CCOC3)n2)C12CCC2,OPXZNWXKBNZBHZ-UHFFFAOYSA-N
|
| 41219 |
+
rxn:2:90102:127548,COc1cccc2c1SCCC(NCC(C)CCN1CCN3CCCCC3C1)C2,WDMJJGACDRCJML-UHFFFAOYSA-N
|
| 41220 |
+
rxn:2:91771:128740,COc1ccc(C)cc1CCC(C)NOCC1CCCCN1CC1CCCO1,ZTHFAGZGOWQWSV-UHFFFAOYSA-N
|
| 41221 |
+
rxn:2:92302:147636,CCC(CNC1c2cccc(OC)c2OCCC1CN1CCOCC1)N1CCCC1,LYYWRHHKLHRPNT-UHFFFAOYSA-N
|
| 41222 |
+
rxn:2:92790:122629,COc1ccc(C(C)NCCOC2CCOC2)cc1CN1CCOCC1,TWCQBKHLRPMUOP-UHFFFAOYSA-N
|
| 41223 |
+
rxn:2:93940:147201,COc1ccc2c(c1)C(NCCC1CCCCC(N3CCOCC3)C1)c1ccccc1CO2,GKDCABKMFSSBCS-UHFFFAOYSA-N
|
| 41224 |
+
rxn:2:94276:127548,COc1ccc2c(c1)SCCCC2NCC(C)CCN1CCN2CCCCC2C1,KDGPXQGMKSIVLI-UHFFFAOYSA-N
|
| 41225 |
+
rxn:2:94905:146149,COc1ccccc1-c1ccc2c(c1)OCCC2NCC1CCC(COC2CCCCC2)O1,FSHZWRDBCJDLFP-UHFFFAOYSA-N
|
| 41226 |
+
rxn:2:95168:103021,COc1cccc(C2(N3CCC(NCC[C@H]4CO[C@H](C)CO4)CC3)CC2)c1,GQTMNYPKZBEJIG-UTKZUKDTSA-N
|
| 41227 |
+
rxn:2:95668:146149,COc1ccccc1-c1ccc2c(c1)OCCC2NCC1CCC(COC2CCCCC2C)O1,CEJHTMNVKCJANG-UHFFFAOYSA-N
|
| 41228 |
+
rxn:2:95668:86915,COc1cc2occc2cc1C(C)NCC1CCC(COC2CCCCC2C)O1,CHTQXLAULGGEHI-UHFFFAOYSA-N
|
| 41229 |
+
rxn:2:97442:128740,COc1ccc(C)cc1CCC(C)NC1CCOCC1OCC1CCCCO1,FBLFPVREWYEFMO-UHFFFAOYSA-N
|
| 41230 |
+
rxn:2:98543:145434,CCC(CNC1c2cccc(OC)c2OCCC1CN1CCCCC1)N1CCOCC1,UZNZRGNEIMAJKN-UHFFFAOYSA-N
|