Added 203 molecules from epoch 17024 for B1WC68
Browse files- B1WC68_molecules.csv +203 -0
B1WC68_molecules.csv
CHANGED
|
@@ -32551,3 +32551,206 @@ rxn:1:64326:24867,CC(=O)C=C(C)N1CC(c2cn(CC3CC(=O)N(c4c(Cl)cccc4C(=O)O)C3)nn2)CC1
|
|
| 32551 |
rxn:1:64326:24956,CCCn1cc(N2CC(c3cn(CC4CC(=O)N(c5c(Cl)cccc5C(=O)O)C4)nn3)CC2=O)cn1,ZNCPIRKRULPGFE-UHFFFAOYSA-N
|
| 32552 |
rxn:1:65076:35459,CCCC1CCN(C(=O)c2ccc(-c3cn(CC4CC(=O)N(c5ncnc6[nH]nc(Br)c56)C4)nn3)c(C)c2)CC1,SNRQDAITKVNHGK-UHFFFAOYSA-N
|
| 32553 |
rxn:2:88568:103647,CCCC(Nc1ccc(CN2CCS(=O)(=O)CC2)cc1)C1CCN(CC)CC1,CKXUAXREZOTRIC-UHFFFAOYSA-N
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
| 32551 |
rxn:1:64326:24956,CCCn1cc(N2CC(c3cn(CC4CC(=O)N(c5c(Cl)cccc5C(=O)O)C4)nn3)CC2=O)cn1,ZNCPIRKRULPGFE-UHFFFAOYSA-N
|
| 32552 |
rxn:1:65076:35459,CCCC1CCN(C(=O)c2ccc(-c3cn(CC4CC(=O)N(c5ncnc6[nH]nc(Br)c56)C4)nn3)c(C)c2)CC1,SNRQDAITKVNHGK-UHFFFAOYSA-N
|
| 32553 |
rxn:2:88568:103647,CCCC(Nc1ccc(CN2CCS(=O)(=O)CC2)cc1)C1CCN(CC)CC1,CKXUAXREZOTRIC-UHFFFAOYSA-N
|
| 32554 |
+
0208ABD06EEF9E34_BC80B5A0E3FBA74F_6041_UN,C1(=CC=C(C=C1)N2CC(=O)CC2=O)NCC3=CC[C@@H](C(C)=C)CC3,MKOWWFNBFHEFEJ-MRXNPFEDSA-N
|
| 32555 |
+
06621B8320045C7E_2570928D9A121594_6038_DP,CCOC(=O)C4=C(NC(C2(ON=C(C1CNC1)C2)C)=O)C3=C(C=CC=C3F)[N]4C,PUEHDAMBXVQLOZ-UHFFFAOYSA-N
|
| 32556 |
+
07AC0DDA3E4ECF94_77DBA33C75CB14F6_6028_UN,N([C@H]1[C@@H](C1)C2=C(C=CC=C2F)F)[S](C3=CC=C(C=C3)OC4CC4)(=O)=O,MBGHEMSBESKEOS-RHSMWYFYSA-N
|
| 32557 |
+
07E4AB0100C72251_C64C8DC0B212556A_6038_UN,CC2=C(NC([C]1(C)C[C](=[CH2])C1)=O)C=N[N]2C[Si](C)(C)C,ITESMHYBHLHWFO-UHFFFAOYSA-N
|
| 32558 |
+
0B6884F70357A8F9_D6A8AEC0A8D4A13F_6041_DP,N1CCN(CC1)C2=NC(=NC=C2)NC3=CC=C(C=C3)O[S](=O)(=O)F,SMPOQEFGITVNED-UHFFFAOYSA-N
|
| 32559 |
+
0B70B31BF7FB8FEA_71988BFE9E089AC1_6041_UN,C[Si](C)(C)C#CC1=CC(=CC=C1)NC2=C(C=CC(=C2)[N]3N=NN=C3C4CC4)F,NZECLPLRTBOSKN-UHFFFAOYSA-N
|
| 32560 |
+
0BA3733B6AAEDAD1_9B64B416AF088DF4_6038_UN,CC(C)(CNC(C1=C(NC(OCC)=O)SC=N1)=O)C(=O)N,HSUTXBYWCSOILD-UHFFFAOYSA-N
|
| 32561 |
+
0C759897A2941304_0992A24711402FA6_6038_UN,N(C1=C(C=CC=C1)[As](=O)(O)O)C(CC2=NC(=NO2)C3C(C)C3)=O,RTQDDORJUUIPGC-UHFFFAOYSA-N
|
| 32562 |
+
0F8ED8A87C898E4F_F9C56EFA2A6DCB9E_6034_UN,C1CN(CCNC1)C2=C3C(=NC=N2)N(C=N3)C(C4=CC=CC=C4)[S](=O)(=O)O,ZUNFDAITXQZILP-UHFFFAOYSA-N
|
| 32563 |
+
10D8A33688DFF8C7_BA7221B1D1E1480C_6041_UN,CC[N]1N=NC2=C1N=CN=C2NC([C@H]3[C@H](C(OC)=O)C3)C,LUHZLSKMLBIRKD-SXNZSPLWSA-N
|
| 32564 |
+
125F558E7BB7C3D1_3E6403CAE4DE7670_6026_UN,O=[N](=O)C1=C(C=CC(=C1)[S](=O)(=O)N3CCN(C2=C(Cl)C=NC=N2)CC3)N4CCOC4=O,FTAJYTPADMZHDW-UHFFFAOYSA-N
|
| 32565 |
+
13FE046DB41CCA7D_A1F80FF8E4656DB1_6034_UN,COC1=CC(=CC=C1)NC3=C2N(C=NC2=NC(=N3)Cl)CC(C(CCC)C)N,VAYLGUCTFNPBTE-UHFFFAOYSA-N
|
| 32566 |
+
141B7399452D8962_53745DDE4E49373E_6041_UN,CN(C)C1=NC2=C(C(=N1)N[C@@H](CCC(=O)O)C(=O)O)C=CC=C2,IFGLMLBEBCJGPI-NSHDSACASA-N
|
| 32567 |
+
1747038742BCD9B7_B114EFB6F0ABE164_6029_UN,CC(=C1C(=NC(=N1)C2=CC=CC=C2)C)N(O)[S](C3=NC(=NS3)C(OC)=O)(=O)=O,CZBINFUZKZSZEB-UHFFFAOYSA-N
|
| 32568 |
+
1AD0DB45AFB2C938_9010FA5D7B9995F6_6028_UN,N(CC1(CCCC1)C2=CC(=CC=C2)Br)[S](C3=CC=C(C=C3)OC4CC4)(=O)=O,JXMVRGBZEGCCSV-UHFFFAOYSA-N
|
| 32569 |
+
1B0D2F26F3BBD5D3_D7310FB535783329_6038_UN,COC(=O)C(C)(C)[C@H](NC(C=C([P](CC)(=O)O)C)=O)C1CC1,TWVWPHXHZKTWEE-CYBMUJFWSA-N
|
| 32570 |
+
1F2989A3A31E2E6D_623A938F5670A87A_6041_UN,C[N]1N=NC2=C1N=CN=C2NC([C@H]3[C@H](C(OC)=O)C3)C,TWJPOACNYYFAPE-ZHFSPANRSA-N
|
| 32571 |
+
21B846A9688115FB_A45CA5B102A05321_6035_UN,COCC(OC1=C(C)C=C(C=C1C)Br)C2=CC=CC=C2,MPLFFRUKUBMUFX-UHFFFAOYSA-N
|
| 32572 |
+
2341669AB6A2BBAF_67AADF1BC2474462_6038_UN,CCN(OC)C(=O)CNC(C1=NOC(C(C)(C)C)C1)=O,ZFKZSDBYEIXGTP-UHFFFAOYSA-N
|
| 32573 |
+
23B027D41558FCB6_9B93288EE936F6A1_6034_DP,C(NC2=C1[N](C=NC1=NC=N2)CC(C(OC)=O)CNC)C3=CC=CO3,RJLIGQMXGHCGBB-UHFFFAOYSA-N
|
| 32574 |
+
24BA77DA1BE5F282_73197EB84EDA4368_6041_UN,C[Si](C)(C)C#CC1=CC(=NC=C1)NC2C3=C(C(C)(CC2)C)C=CC=C3,DDZDFXJEUWOLTP-UHFFFAOYSA-N
|
| 32575 |
+
24F11CFCDB048BF5_41A979ACECAC8F10_6038_UN,CCC(NC(C2ON=C(C1=CC=CC(=C1)OC)C2)=O)C3=NN=N[NH]3,GFZSYYBQGAFCRL-UHFFFAOYSA-N
|
| 32576 |
+
25FB8589562FC906_06F1C6B982557D19_6028_UN,N(C1CC(C1)=C2CCC2)[S](C3=CC=C(C(C)C)C=C3)(=O)=O,FHYHZFAENJGCAO-UHFFFAOYSA-N
|
| 32577 |
+
26619D8457908A89_303F32726C8D0BC2_6038_DP,CC2=C(NC(C1(COC)CNC1)=O)C=N[N]2C[Si](C)(C)C,AZHGTCMMIFVACE-UHFFFAOYSA-N
|
| 32578 |
+
270D0B5625A6FFAD_1353A0DD773CB255_6038_UN,COC(=O)C1=C(C=C(C(=C1)Br)F)NC(C2=N[NH]C(=C2)CCCCC)=O,XHZYEWXLSHQHEW-UHFFFAOYSA-N
|
| 32579 |
+
285C092CD979197B_EAE6FE0E7F6CAEAE_6029_DP,N(N[S](C2=CC1=CC=CC(=C1N=C2)OC)(=O)=O)CC=C,CEDBSINCHGTWQW-UHFFFAOYSA-N
|
| 32580 |
+
29572AEACF2F2E54_E5F03F984510EFDC_6041_UN,O[B-](O)(O)C1=C(C=CC=N1)NC2=CC(=C(C=C2)F)[N]3N=NN=C3C4CC4,XGMWAJMGVOWQBL-UHFFFAOYSA-N
|
| 32581 |
+
2988BE9F16E6BCFD_CB838824B3548C18_6038_UN,O(C2=CC(=O)C1=C(C=CC=C1)C2=O)C(C#CC3(C)CC3)=O,JJNJENOXGPVIIW-UHFFFAOYSA-N
|
| 32582 |
+
2AD0E9265CAA9D1D_C598A53BE08C714B_6041_UN,C[S](=O)(=O)C1=NC(=CC(=N1)NC4=CC=C(OC2=CC=NC3=CC(=C(C=C23)OC)OC)C=C4)C5CC5,YGVJXULUMOOAKB-UHFFFAOYSA-N
|
| 32583 |
+
2B66C3320DDEE790_147323540C1F6973_6035_UN,C[Si](C)(C)C#CC(OC1=NC(=C(C(=N1)C)Br)C)CC2=CC=CC=C2,DXIKUZPHJJNCRX-UHFFFAOYSA-N
|
| 32584 |
+
2E10C88E281DAE34_0986E70988F08D7A_7017_UN,CC1(C)CCC(C)(C)C2=C1C=CC(=C2)[S](=O)(=O)N3CCCC4C(Br)C34,NOAYCUJKRFOBTC-UHFFFAOYSA-N
|
| 32585 |
+
2E2358193E158A4E_A0C12780047C1970_6041_UN,OC(=O)C1=C[NH]C2=C1C(=NC=N2)NCC(C(OCC)=O)(CC)CC,DAPYFFPSXVPNBW-UHFFFAOYSA-N
|
| 32586 |
+
3010D07D65A118C0_EE3687ECA39E9531_6038_UN,CC[C@@H](NC(C1=C(NC(OCC)=O)SC=N1)=O)C(=O)N,HDLTVVSCTTZRKP-ZCFIWIBFSA-N
|
| 32587 |
+
30FDB5E0F5616EB6_B51F614D8AE59210_6034_UN,CC1=CC(=O)N(C(=N1)N2CC(C2)N)CC(CC)NCC3=C(C=C(C=C3)Cl)Cl,ZGENOBIOPZWULF-UHFFFAOYSA-N
|
| 32588 |
+
343B0FBB8C1C71B3_EAE4A31036B937E8_6031_UN,CC(=C(C[P](=O)(O)O)C(=O)OC[C@H](C1=N[NH]C(=N1)C)N)C,IHHHUBVRSVQHOE-SECBINFHSA-N
|
| 32589 |
+
347AFDDC732C0806_3E13902465934EE4_6038_UN,CC3=CN1C(=NCC(C1)OC(=O)CC2=CN=NS2)C=C3,YKYLFLWWCUQURY-UHFFFAOYSA-N
|
| 32590 |
+
35C3E9AD3FB09952_170AAAAEEC44CC49_6031_UN,O(C(=O)CC1=C(N=CN=C1Cl)Cl)CCCNC(=C2N=CC=CC2=O)O,FRTVEBXKVGXVDC-UHFFFAOYSA-N
|
| 32591 |
+
36264BF0CC5D1C53_556CD6F87D0B6326_6003_UN,COC2CCC(COC1=CC=C([S](C(C)C)(=O)=O)C=C1)CC2,ZKCJOVHQGMFVLK-UHFFFAOYSA-N
|
| 32592 |
+
38B495F1E924030D_4EB9D6B6C8A6C239_6038_DP,CCOC(=O)C(NC(C(C(C)C)N1C(=O)C=CC1=O)=O)CC2CNC2,NEOOAOLEZSPRTC-UHFFFAOYSA-N
|
| 32593 |
+
39513170AAD89213_1FA642DFD208E8D8_6041_UN,OC(=O)C1=C[NH]C2=C1C(=NC=N2)NC3C(CC)(CC)C(C3C)OC,WXZVGZPOLALQSO-UHFFFAOYSA-N
|
| 32594 |
+
3AB0DB7D7EFE611A_399E8F413EA77370_6038_UN,CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CCNC(C(C(CC)C)C)=O,UQQULRZMHJDHBH-UHFFFAOYSA-N
|
| 32595 |
+
4106B2ACDAD049EA_258BABF04310109F_6029_UN,CC(=C1C(=NC(=N1)C2=CC=CC=C2)C)N(O)[S](C4=CN=C(N3N=C(C)CC3=O)C=C4)(=O)=O,JMMHOGLQBYCJGN-UHFFFAOYSA-N
|
| 32596 |
+
443E577BF72CAF6F_5F95F92C7404B8BA_6041_UN,FC1=CC=C(C=C1)CC2=NN=C([NH]2)NCCC#C[Si](C)(C)C,IPSDPRMSMBTXNM-UHFFFAOYSA-N
|
| 32597 |
+
44F2F1FE4EB67CC8_6E0F66CF9D66298F_6038_UN,N([C@@H]1C(NC(CC1)=O)=O)C(C2=C(CC)C=CC(=C2)[N](=O)=O)=O,GHIWIHFNKFKIIA-NSHDSACASA-N
|
| 32598 |
+
45462D1A5FF574D0_E79FDF815D4950BE_6038_UN,NC1=C(C(NC(N1)=O)=O)OC(C(CCC(OC)=O)(C)C)=O,CRVMMMVTYOSXIF-UHFFFAOYSA-N
|
| 32599 |
+
457A5F4FFC2294A0_A814B9119099041A_6038_UN,N(C1=C[N](=CC=C1)=O)C(C(CC)SC2=NC(=N[NH]2)N)=O,VSZAMJKKOVJBEI-UHFFFAOYSA-N
|
| 32600 |
+
470FF6EA5E7722B6_7EA379938F9CFFF3_6038_UN,N(CC[N]1N=CC(=C1)[N](=O)=O)C(C3(C2=NN=C(C)[N]2CC3)C)=O,UNTJHVCMKRTYJV-UHFFFAOYSA-N
|
| 32601 |
+
48E8B8B452CF0842_A0F7A9BF758E683A_6034_UN,NC3=NN=C(NC1COC2=C1C=CC=C2)N3CC(COC)(C)N,MTSSPYNHJXBZEU-UHFFFAOYSA-N
|
| 32602 |
+
4924AA19F69F1075_5673107B8E51C0EF_6029_UN,CC1C4=C(CC(CC1)CN[S](C2=CC=C(S2)C3CC3)(=O)=O)C=CC=C4,CZXXQNSKQANRHX-UHFFFAOYSA-N
|
| 32603 |
+
4963B4132B8C5FCD_32D7C91B48400452_6038_UN,N([C@@H]1C(NC(CC1)=O)=O)C(CCCOC2=CC=CC(=C2)C(C)=O)=O,RWCWWYIGTNSDQX-AWEZNQCLSA-N
|
| 32604 |
+
4A48E94C052F8ECA_B4810D9C7A4427CC_6038_UN,N(C1=C(C=CC=C1)[As](=O)(O)O)C(C(CC)C2CCC(C)CC2)=O,PIBABIAGUOZREI-UHFFFAOYSA-N
|
| 32605 |
+
4E4EB3CE7619A6EE_E4E49DEA2ABF3EC6_6031_UN,CC(=C(C[P](=O)(O)O)C(=O)OCC1(CC)C(=O)NC(=O)NC1=O)C,DSYYLVPXHVLWRT-UHFFFAOYSA-N
|
| 32606 |
+
4F2C99DBC00B49D6_1069B6BEB8E8A0CE_6029_UN,FC1=C(C=CC=C1Cl)C2=CCN(CC2)[S](C4=CC3=C(N(C)C(=O)CCO3)C=C4)(=O)=O,LYLMQQCSFOOVCF-UHFFFAOYSA-N
|
| 32607 |
+
4F430B0E502DBFC7_5B9BBAFF3BFF0FB8_6029_UN,C1C(CN1[S](C2=CN=C3N=C(Cl)C=C[N]23)(=O)=O)C4=NOCC4,VTIBILWFHNYXLQ-UHFFFAOYSA-N
|
| 32608 |
+
4F7AB21EEBB6A83B_BFA891738DA42BA4_6035_UN,C[Si](C)(C)C#CCOC1=NC(=NC2=C1C=C(Br)C=C2)C,XCSKHSDBVUPTQJ-UHFFFAOYSA-N
|
| 32609 |
+
5224A9A3F9FAA071_377001034CB9D572_6009_UN,C1(=CCNCC1)C2C(C(C)C)C3=C(OC2=O)C=C(C=C3)O,GGKLXBFDIGZDIQ-UHFFFAOYSA-N
|
| 32610 |
+
5338DEAA6CDB6FA5_85F7D363028EB9A2_6041_UN,FC2=C(C=C1C(=NC=NC1=C2)NC4CCC(C3=CC=C(C(C)(C)C)C=C3)CC4)F,PPVASUAYBSMBOL-UHFFFAOYSA-N
|
| 32611 |
+
54E59F654C8F9EF8_FB68CEF83C3A5E2B_6029_UN,C1CN(CCN1[S](C3=CC2=C(N=CC(=C2Cl)[N](=O)=O)C=C3)(=O)=O)C4=NN=C(C=C4)[N]5C=CC=N5,HMLYQSWSZLPFDN-UHFFFAOYSA-N
|
| 32612 |
+
5590888681EF7730_25F16CDEFEC86170_6041_UN,OC(=O)C1=C[NH]C2=C1C(=NC=N2)NC4=C(N3CCN(C(C(C)(C)C)=O)CC3)C=CC=C4,QJMFWHINBSPXNC-UHFFFAOYSA-N
|
| 32613 |
+
5AA83295AD082E9F_9D8216D40B7B3051_6038_DP,N(C1=C(C=CC=C1)[As](=O)(O)O)C([C@@H]3C[C@H](NC2CNC2)C3)=O,TWDJMILJADBWCJ-AOOOYVTPSA-N
|
| 32614 |
+
5D7E92CCECCE1F0F_11A90BA4F244A274_6003_UN,CC2CCC(OC1=CC=C([S](C(C)C)(=O)=O)C=C1)CC2,AMBQUADHGXGPBA-UHFFFAOYSA-N
|
| 32615 |
+
5F7227BD51EBE427_46A19BE2BB61F4C1_6029_UN,N(C(CB(O)O)C(=O)O)[S](C1=C[N](C)N=C1CN2C(=O)C=CC2=O)(=O)=O,PQKDZFIERVSOFM-UHFFFAOYSA-N
|
| 32616 |
+
5FA1F99B01A43E66_5C2F4C642A6723A6_6028_UN,N(CB(O)O)[S](C2=NN=C(C1=CC=C(OC)C=C1)[N]2CC(C)C)(=O)=O,HAAZSXXZBJAYBR-UHFFFAOYSA-N
|
| 32617 |
+
606987483EEB64AC_95746918D8912023_6038_UN,CC2=C(OC(C(=NOCC(OCC)=O)C1=N[NH]C=C1)=O)C(=O)OC2,FVBMVUFIPPMLBP-UHFFFAOYSA-N
|
| 32618 |
+
6206BEB9A5E0B55E_D1A41BD3C74D7403_6029_DP,N1CCNCCN1[S](C3=CC=C(C2=NC=CC(=N2)Cl)C=C3)(=O)=O,WJLDKUOHHJHZPQ-UHFFFAOYSA-N
|
| 32619 |
+
626773952E5504A5_7075E524BD21F69D_6038_UN,CC2=C(CCOC(=O)CN1C(=O)NNC1=O)SC=[N+]2CC3=C(N=C(N=C3)C)N,ITULIPFYMOFTIB-UHFFFAOYSA-O
|
| 32620 |
+
64C2B7A93DC2CE5B_732AE40BB8A09A8D_6034_UN,CC3=CC=C(CNC2=C1N(C=NC1=NC(=N2)Cl)CC(C(OC)=O)(C)N)O3,BQLNTDLRWMPFCU-UHFFFAOYSA-N
|
| 32621 |
+
64C81EEC5F0A894E_9B39E7C0D817866A_6041_DP,N4CCOC1(CCN(C1)C2=NC(=NC=C2)NC3=C(C=CC=C3)[As](=O)(O)O)C4,JKJMXXKOQCMQDG-UHFFFAOYSA-N
|
| 32622 |
+
65A1E51A5E081BDC_E5FC4BB158181968_6041_DP,N1CC(C1)[N]2C=NC3=C2N=CN=C3NC4=C(C(=C(C(OC)=O)C=C4)C(=O)OC)F,BNLXVMUCGVRCGY-UHFFFAOYSA-N
|
| 32623 |
+
69F50C88FA643F99_CF88CCD389C68FF7_6028_UN,N(CC1(CCC1)C2=CC=C(C=C2)F)[S](C3=CC=C(C=C3)OC4CC4)(=O)=O,ZNWXOUXDLMJLON-UHFFFAOYSA-N
|
| 32624 |
+
6EF9753AD7506011_C8EF4638FB640193_6038_UN,N(CCC1=C[NH]C2=C1C(=CC(=C2)F)F)C(C3=CC=NC(=N3)CC(C)C)=O,YPQHRHMGMASLJF-UHFFFAOYSA-N
|
| 32625 |
+
71DE48546A3E0885_A27CD689CB994020_6029_UN,N(C(CB(O)O)C(=O)O)[S](C1=C[N](CC(N(C)C)=O)N=C1)(=O)=O,OZWNJXNOQPAYHU-UHFFFAOYSA-N
|
| 32626 |
+
72027ADA97C72D74_1DAF071408FECEF0_6029_UN,N(CC1CC(C1)(F)F)[S](C2=CC=C(C=CCO)C=C2)(=O)=O,RTMIYQNFHXOBIK-UHFFFAOYSA-N
|
| 32627 |
+
7287D46E6559CAC7_6D6FF559A18A81AA_6026_UN,ClC1=CC2=C(C=C1)SC=C2[S](=O)(=O)N(C3=C(C=C(F)C=C3)I)C4CCC4,AHNFSFIZWJWEEV-UHFFFAOYSA-N
|
| 32628 |
+
74F601178CAD5759_0C37932CE8F5AAF1_6029_UN,CN1N(C=C2CN=C(Cl)N=C12)[S](C3=C(C=CC(=C3)C(C(OC)=O)Cl)Cl)(=O)=O,GYMJKTHUZOSAME-UHFFFAOYSA-N
|
| 32629 |
+
7641A59B48CDF48E_123E65F63F2DA577_6028_UN,N(C1(CC1)C#C)[S](C2=C(C)C=CC(=C2)C(C)(C)C)(=O)=O,FTLQMYJNEHXJHB-UHFFFAOYSA-N
|
| 32630 |
+
780F9BBDD84D4ADC_944B6E0D07E66DAC_6039_UN,C[C@@H]2C[C@H](OCC(OC)C1=CC=CC=C1)CC(C)(C)C2,JNXJUCRFJIMZKB-UMFITKPXSA-N
|
| 32631 |
+
78D6D1F901CA9275_336FA799F03EF880_6041_DP,N4CCC1(CN(C1)C2=NC(=NC=N2)NC3=C(C=CC=C3)[As](=O)(O)O)CC4,JLBUHPQSBMIZQA-UHFFFAOYSA-N
|
| 32632 |
+
78E315E8F936E46D_B3017CAB982AA3F7_6034_UN,C1N[C@@]2(C1)C[C@@H](C2)C3=NC=CN3CC(C(C)(C)F)(C)F,GJXQAEYNXSYFOI-WGHXENDZSA-N
|
| 32633 |
+
7BC173BCA3CE0545_E420359633946153_6029_UN,C2N=C1C=CN(C=C1C2)[S](C3=C(C=CC(=C3)C(F)(F)F)C=C)(=O)=O,CYMWWHZXPGTUMN-UHFFFAOYSA-N
|
| 32634 |
+
7CC2973AA011F6A9_CBBD70F53F393658_6035_UN,C[Si](C)(C)C#CC(OC1=CC=C(C=C1)C2=CSN=N2)CC3=CC=CC=C3,LGIIPTIHZPNWIO-UHFFFAOYSA-N
|
| 32635 |
+
7D9C8631E6F1E72D_E1AC35BC596738B7_6034_DP,CNC2=C1[N](C=NC1=NC=N2)CC3(CC(OC)(C3)OC)CN,CQJXODSVTVNZSJ-UHFFFAOYSA-N
|
| 32636 |
+
8028FE41BBAB7701_162272DFD622AC68_6034_UN,CC1=CC(=O)N(C(=N1)N2CC(C2)N)CC3=C(C=C(SCC)C=C3)Br,SVTXCHIQGVKZGM-UHFFFAOYSA-N
|
| 32637 |
+
825820838AA3E657_9E955745653812B5_6038_UN,O(C1=CC=C(C=C1)[S](=O)(=O)O)C(=O)C3=C(N=C2N=CC=CC2=C3)C4CC4,DOACMVYGUNMQFZ-UHFFFAOYSA-N
|
| 32638 |
+
83A189381391CC77_E41254BBF69FFAF8_6041_UN,O[S](=O)C1=C(N=CC=C1)NC2C3=C(OCC2F)C=CC=C3,RDGALDZFMRHQEQ-UHFFFAOYSA-N
|
| 32639 |
+
86FA3DA1D5713179_7FDFBB381F2D11D6_6029_UN,ClCC(=O)C(=C2N(C1=C(C=CC=C1)S2)[S](C3=CN=C(N=C3)N4CCC(=O)CC4)(=O)=O)C#N,ZIWLKFWHJVIUEM-UHFFFAOYSA-N
|
| 32640 |
+
8981E07DE5CC4A38_411A434AB56E02EE_6041_UN,C[N]1C=CC2=C1N=CN=C2NC[C@H](CC(OCCOC)=O)CC(C)C,DZSZAILFDAEKFM-AWEZNQCLSA-N
|
| 32641 |
+
8C3DFE54679D8F63_6F64269FE13008A4_6026_UN,CC1=C(C=CC(=C1)[N](=O)=O)[S](=O)(=O)N3CCN(C2=NC=C(I)C=N2)CC3,AEWOVWYRHIGEPZ-UHFFFAOYSA-N
|
| 32642 |
+
8C6D465EF6DE979A_B33E3A87EFE43E99_6039_UN,O(CCN1C(=O)CNC1=O)CC(NC(C2=C(OC)C=CC=C2)C)=O,UTTRSIAMWPDWMP-UHFFFAOYSA-N
|
| 32643 |
+
8C9BCF25E46CE275_6CBB2EA14B39067C_6035_UN,COC(COC2=CC1=C(OC(CC1C)=O)C=C2)C3CC3,OFYDJJUOYNOXRD-UHFFFAOYSA-N
|
| 32644 |
+
8D8C317D50C3D202_8969202C0B02F858_6038_UN,CCC2(COC(C1=C(NC(OCC)=O)SC=N1)=O)C(=O)NC(=O)NC2=O,WPQASEFDHBVDOP-UHFFFAOYSA-N
|
| 32645 |
+
8F4DF39B515CC91E_216B4083510EC47D_6038_UN,N(C1=CN(C(C=C1)=O)CC2=CC(=C(C=C2)Cl)Cl)C(C3=N[NH]C(=C3)C(C)C)=O,WVKWWTKFQGVPSK-UHFFFAOYSA-N
|
| 32646 |
+
9128349F555021A3_E89267C1E13FB304_6029_UN,C1CC(CCN1[S](C2=CC(=CC=C2)CCC=C)(=O)=O)C4=NC3=C(C=CC=C3)S4,HTNAHNTXQSLISX-UHFFFAOYSA-N
|
| 32647 |
+
9225086C18316269_0D331D3DCA3D35F9_6041_UN,C1(=NC2=C(C=C1)C(=O)CC2)N[C@@H]3C4=C(OC(C)(C3)C)C=CC(=C4)F,YPMNLZKXZJFJEB-HNNXBMFYSA-N
|
| 32648 |
+
9299FCB72351D738_436DEC732B5A545D_6034_UN,ClC1=CC2=C(C=C1)N(C(=N2)C3CCCN3)CC(NC)C(C)(C)C,BOEYTTYVHCWWKD-UHFFFAOYSA-N
|
| 32649 |
+
92B523B29F8390BD_4FD0C075460ABE6A_6038_UN,CC3=C(NC(=O)C2=CN1C(=NCC1)C=C2)C=N[N]3C[Si](C)(C)C,OUMDOMOKKAJWNN-UHFFFAOYSA-N
|
| 32650 |
+
9466B8051D9C897C_2A40A3F7321D0178_6006_UN,N[S](=O)(=O)C2=C1C=CN=C(C1=CC=C2)C3=C(C=CC(=C3)C4(CC4)C#N)F,KCYCQAWFUCYQOS-UHFFFAOYSA-N
|
| 32651 |
+
97C103D7ABF85E1E_CAFFD55EBD58F58E_6034_UN,CC1=NN=C(N1CCCNC(=C2N=CC=CC2=O)O)[S](=O)(=O)F,YGGSMMQAXCGTQS-UHFFFAOYSA-N
|
| 32652 |
+
9F80E54124C4ADC9_360C5410BA8B3077_6029_UN,OC2=C1CC(CCC1=N[N]2[S](C3=C(Cl)C=C(C=C3)C4(CCC4)C#N)(=O)=O)C5=CC=CC=C5,FNAUGHNVBKIFDK-UHFFFAOYSA-N
|
| 32653 |
+
9FB3792877DE4741_11EFEE44842F465C_6031_UN,CC1=C(CCO1)C(=O)OCC(OC)CC2=CC=CC=C2,GDOSQWUEKXJTAT-UHFFFAOYSA-N
|
| 32654 |
+
A013A02547777081_3324FE30DD533555_6038_DP,COC(=O)C(NC(C(C(OCC)=O)(C)C)=O)C1CNC1,HENZIGQAKQJLEI-UHFFFAOYSA-N
|
| 32655 |
+
A09168E1A866FC3E_DD8D0226779906C5_6026_UN,CC1=C(C(=CC(=C1)[N](=O)=O)[S](=O)(=O)N3CCN(C2=C(Cl)C=CC=N2)CC3)F,JMIORZKSAAJISJ-UHFFFAOYSA-N
|
| 32656 |
+
A12780EC70AC1C10_3B9D0E572726BFD1_6034_UN,CC1=C(N(C=N1)CCCNC(=C2N=CC=CC2=O)O)[S](=O)(=O)F,ZWVNSFNYUGALJV-UHFFFAOYSA-N
|
| 32657 |
+
A13B99C5A1F42B03_36E0CBF9F06EA95A_6038_UN,N(C1=C(C=C(C(=C1)C#N)F)F)C(C2=N[NH]C(=C2)CCCCC)=O,IXOLLCFJNRTRNQ-UHFFFAOYSA-N
|
| 32658 |
+
A3C190F88594D370_D51119EF31C819E1_6028_UN,N(C1=C(CCCC1)C#N)[S](C3=NN=C(C2=CC=CO2)[N]3C4=CC=C(C=C4)Cl)(=O)=O,KYRAOIYLIIJGDK-UHFFFAOYSA-N
|
| 32659 |
+
A528C540A36A946C_C98C6A4ECDB260D4_6041_UN,FC2=C(C=C1C(=NC=NC1=C2)NC4(C3=CC=C(C(C)(C)C)C=C3)CC4)F,HYILUNPSXDFAIV-UHFFFAOYSA-N
|
| 32660 |
+
A69FC66F959612AF_83368C12BDBCF22A_6041_DP,C2(=C1C=CC=CC1=NC(=N2)C3=CN=CC=C3)NC4C5(C(O)C4)CCOCC5,YDRNKGXRKLTREK-UHFFFAOYSA-N
|
| 32661 |
+
A767C81952F09230_9548FB6CB6582FF4_6038_DP,CC1=C(C=CC(=C1)NC(C3ON=C(C2CNC2)C3)=O)[S](=O)(=O)F,NUGSKQWZOOJZKI-UHFFFAOYSA-N
|
| 32662 |
+
A96FB5237C954D8B_3CEEA633B4702CA0_6026_UN,[S](=O)(=O)(C1=CC=C(C=C1)OC2CC2)N(C3=CC=C(Cl)C=C3)C4(CCC4)C#N,WUQUYUXAQVSYDR-UHFFFAOYSA-N
|
| 32663 |
+
AAE71CF5457D5C8A_0CAF7C14C32263B1_6026_UN,ClC2=C(C=C1C=CC=CC1=C2)[S](=O)(=O)N(C3=C(C=C(F)C=C3)I)C4CCC4,NZBHHHUANYCJHZ-UHFFFAOYSA-N
|
| 32664 |
+
AB04C4C619C608FE_1F795C3A73C75280_6006_UN,CC1=NC4=C(C(=C1)C2=CC=C(C=C2)C3(O)CCC3)C=CC=C4F,HUGAGPBTFSLVLB-UHFFFAOYSA-N
|
| 32665 |
+
AC8011E30C7AD0C0_2EEB5E8CB39BFC28_6041_UN,C[Si](C)(C)C#CC1=NC=C(C=C1)NC3=C2C(C)CC(C)(C)C2=C(C=C3)F,WVVVGQNHEREPPR-UHFFFAOYSA-N
|
| 32666 |
+
ACB8D410FF90CA6A_0654FD3D5B0C64D5_6038_UN,N(C1=C(C(=C(C=C1F)F)F)I)C(C2=N[NH]C(=C2)CCCCC)=O,UBSHXUPCLHRGLN-UHFFFAOYSA-N
|
| 32667 |
+
ACF5CB5436F57BEA_B654BC3BED8E8A56_6035_UN,CC(OC2=CC1=C(OCC1(C)C)C=C2)C3CCC(=O)O3,LLAKNUHUBMBYFA-UHFFFAOYSA-N
|
| 32668 |
+
AF60434EA7E84AC3_E92C324ED26EACC2_6026_UN,[S](=O)(=O)(C1=C(C=CC=C1)C2CC2)NC(C)(C3CC3)C4CC4,JRDUDECQWHJKJK-UHFFFAOYSA-N
|
| 32669 |
+
B2E5BCA7B891DC54_B88545F9F8E28573_6035_UN,CC(OC2=CC=C(B1OC(CN(C)CC(O1)=O)=O)C=C2)C3CO3,OTDJLWZQNYGSHE-UHFFFAOYSA-N
|
| 32670 |
+
B511F756CC21483C_4582EF8D2C28607D_6035_UN,C[Si](C)(C)C#CC(OC1=C(C=NC2=C1C=C(C)C=C2)C)CC3=CC=CC=C3,HZNAGKBBWXNIQV-UHFFFAOYSA-N
|
| 32671 |
+
B5269BC169E5C10D_D63A47E5C2C1F046_6041_UN,FC2=C(C=C1C(=NC=NC1=C2)NCC(C(OC)=O)CC3=C[N](N=C3)C)F,IQZMJQRKEYTSRY-UHFFFAOYSA-N
|
| 32672 |
+
B58636F804868851_B8D60247C3A9E591_6029_UN,CC1=C(C=CC=C1)C4(N[S](C2=C(C=CC=C2)C3CCC3)(=O)=O)CCCCC4,DNDKNIPUEOMAIR-UHFFFAOYSA-N
|
| 32673 |
+
BC1CDFFF8527C15A_ECAE1B6425E294EC_6039_UN,CC(C)C2CCC(OCC(OC)C1=CC=CC=C1)CC2,DVTLQMYRGLUISE-UHFFFAOYSA-N
|
| 32674 |
+
BD25B87CD5257EDF_9FBFE6220A132402_6038_UN,CC(NC(CC(CCC)CCC)=O)C1=CC(=CC=C1)N2CCCC2=O,TUFPCODZOKFWIF-UHFFFAOYSA-N
|
| 32675 |
+
BF413DF60BFC5850_DF88F7461FB8B853_6026_UN,[S](=O)(=O)(C1=CC(=CC=C1)C2CC2)NC3CC(CCOC)C3,RYQXDSYHAUIAAL-UHFFFAOYSA-N
|
| 32676 |
+
BFCF212E72B434BB_710EDAF62A673B04_6028_UN,N([C@H]1[C@@H](C1)C2=C(C=C(C=C2)Cl)Cl)[S](C3=CC=C(C=C3)OC4CC4)(=O)=O,QUKQOTHEOZHNNW-FUHWJXTLSA-N
|
| 32677 |
+
C06EDB78FB2107C1_C32ED12891C02D18_6041_UN,FC1=CC2=C(C=C1)N=CN=C2N[C@@H]3C[P](C[C@H]3O[Si](C)(C)C)(=O)C,SJPIVCDUXLYOMG-AULLONERSA-N
|
| 32678 |
+
C381BAFF620CD549_B1CC99FB63AF42AE_2201_UN,CC3=CC2=NC1=C(C=CC=C1)C(=C2C(C3)C4=CC=CC=C4)C5CCCC5,YEOGOTMNYSXHGD-UHFFFAOYSA-N
|
| 32679 |
+
C45F34F6C94DCEF9_C468A88F2919CF41_6036_UN,C(CCNC(=C1N=CC=CC1=O)O)N([S](C2=C[N](C)N=C2)(=O)=O)CCBr,OULKQNCFQNFBLX-UHFFFAOYSA-N
|
| 32680 |
+
C5859D26524E9D92_57D9B0D7DCF0F75F_6041_UN,C[Si](C)(C)C1=C(N=C(C=C1)N[C@@H]3C2=C(C(=C(C)C=C2)C)OCC3)F,PWUIEVAIVMDQGK-HNNXBMFYSA-N
|
| 32681 |
+
C654504723454B63_82E7B6A6BD170EC1_6026_UN,C[N]1C=C(C(=N1)[N](=O)=O)[S](=O)(=O)N3CC=C(C2=C(F)C(=CC=C2)Cl)CC3,IPMQGGJYVHAKIS-UHFFFAOYSA-N
|
| 32682 |
+
C763D092AC53A758_941613C3961E8A5D_6035_UN,CC2(CCCOC1=C(C(OC)=O)N=C(C=C1)Br)C(=NNC2=O)N,ODPPRJBFXWRFJX-UHFFFAOYSA-N
|
| 32683 |
+
C96D1E9681B126A0_86A509C6FDFE8C5E_6039_UN,CC2=C(OCC(NC1=C(C(NC(C)C)=O)C=CC=C1)=O)C(=O)OC2,VTXYUPGRXRFMIL-UHFFFAOYSA-N
|
| 32684 |
+
CA43211DD465AF67_3F02FF3C69BB340F_6038_UN,N(CC1ON=C(C1)C(=O)N)C(C=C([P](CC)(=O)O)C)=O,GNQASGXCTNWHAV-UHFFFAOYSA-N
|
| 32685 |
+
CAF9C65FA052B394_6F52A7344DAAB3EE_6041_UN,C1(=CC=C(S1)C2(CCC2)C#N)NC3=C(C)[N](N=C3)C[Si](C)(C)C,IAPYJSSFEWKWHU-UHFFFAOYSA-N
|
| 32686 |
+
CB8A8B235E3CE093_B3EB2072F2844284_6041_UN,FC1=CC=C(C=C1)[N]2C(=NN=C2C3CC3)NCC#C[Si](C)(C)C,XOKCVUGYEKSUHS-UHFFFAOYSA-N
|
| 32687 |
+
CBAA6D23FFABEB65_BE106CA7C1EE0D71_6041_DP,N1CCCN(CC1)C2=NC(=NC=N2)NC4=C3C=CC=C(C3=CC=C4)[S](=O)(=O)O,QGGFBUBURFGYAA-UHFFFAOYSA-N
|
| 32688 |
+
CC51D8F59893E99C_5128DE9F1CD664F6_6038_UN,CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CCNC(C(CCCC)C(C)C)=O,ZIKVRMIUSOIFIH-UHFFFAOYSA-N
|
| 32689 |
+
CC93E9D304D51138_34225937F01DEF7B_6041_UN,OC[C@H](O)C1=CC=C(C=C1)NC2COC3=C2C=C(C)C=C3,BMGIZGYEYQBYED-LYKKTTPLSA-N
|
| 32690 |
+
CE5480943B7B349B_1806408A06713854_6029_UN,N(C1=CC(=CC(=C1)C2C(C2)(F)F)C(F)(F)F)[S](C3=CC(=CC=C3)C=C)(=O)=O,YLETURMBLQZAJK-UHFFFAOYSA-N
|
| 32691 |
+
CE717EE3DDD5FC1A_A42C6EA2645ED5C0_6029_DP,N#CC1=CC=C(C=C1)N2CCCN(CC2)[S](C4=CC=C(C3(CNC3)O)C=C4)(=O)=O,CZCGUFJNILESRI-UHFFFAOYSA-N
|
| 32692 |
+
CF09BC14A07EC290_83ADA0ABECDDC8A0_6028_UN,N(CCC1=CC(=CC(=C1)F)F)[S](C2=CC=C(C=C2)OC3CC3)(=O)=O,ZGXDJZCXJUNXGK-UHFFFAOYSA-N
|
| 32693 |
+
D090CD8C6A5D5713_4A058E6C10E8015F_6028_UN,ON(CC=C[P](=O)(O)O)[S](C2=NN=C(COC1=C(C=CC=C1)Cl)[N]2C3CC3)(=O)=O,RPHUOSZPYCQGTP-UHFFFAOYSA-N
|
| 32694 |
+
D16376DA863682D5_9E82D65EF1B2EAF7_6041_UN,CC(C)CC(=O)C1=CC=C(C=C1)N[C@@H]2[C@H](OC)COC2,WLSRJSGZFWFSHY-GOEBONIOSA-N
|
| 32695 |
+
D1B52B5B61C68381_6F92A2EF14026DE2_7013_UN,CC[N]2C1=CC(=CC=C1N=C2C3CCC(=CC3C)C)F,FAUXBGVPNHLXCX-UHFFFAOYSA-N
|
| 32696 |
+
D2364052521A9C08_F7B609B851C2F4FE_6038_UN,COC(=O)N(C)C1CC(C1)NC(C(C(OCC)=O)(C)F)=O,KNLFJDVRPRPPAB-UHFFFAOYSA-N
|
| 32697 |
+
D50C167593DAD6F9_5F27AAAB181134ED_6041_UN,C2(=C1C=C[NH]C1=NC=N2)NC[C@H](CC(OCCOC)=O)CC(C)C,UQYIZXNBHMWUSN-ZDUSSCGKSA-N
|
| 32698 |
+
D56C0F1D264A220E_B50E76E179D645F7_6029_UN,FC1=CC=C(C=C1)C3=C[N]2N=C(SC2=N3)N4CCN(CC4)[S](C5=NC=C(B(O)O)C=C5)(=O)=O,DBECZCPVXUGZDD-UHFFFAOYSA-N
|
| 32699 |
+
D8D10B68999E1540_FAB84E501C674413_6035_UN,CN2C(=C(COC1=C(C(OC)=O)C=C(C=C1I)Br)C[N]3N=NN=C23)C,VBWSVPYDFHIDNR-UHFFFAOYSA-N
|
| 32700 |
+
D91CBEA3BE98F5A8_1A6BCFE96E4A2CA6_6035_UN,CCOC(=O)C1=CN=[S](=O)(C)C=C1OC2=NN=C(C=C2)Br,NQBPWMIFGYMMGQ-UHFFFAOYSA-N
|
| 32701 |
+
DA1D46E5B6B8DF21_489B5374BE85F40B_6038_UN,N([C@H]1C2=C(OCC1)C(=CC=C2F)F)C(C4(C3=CC=CC(=C3)[S](C)(=O)=O)CCCC4)=O,ZVEFMQWAPWFRBG-GOSISDBHSA-N
|
| 32702 |
+
DF6AA868BADFD86D_D82ED20FBED0B064_6026_UN,[S](=O)(=O)(C1=CC=C(C=C1)C2(CC2)C#N)NC(CC)C3CC3,VQEJQFYFRDNSPF-UHFFFAOYSA-N
|
| 32703 |
+
DF87A9EAA6B95383_D0FA8DD919C17C99_6038_UN,N(CCC1=C[NH]C2=C1C=C(C(=C2)Cl)F)C(C3=CC=NC(=N3)CC(C)C)=O,PXJZVGBRDGWSNL-UHFFFAOYSA-N
|
| 32704 |
+
E2DE3AFD1B679A42_0E4D6D84EE692605_6041_UN,O[S](=O)(=O)C4=NC1=C(C=C(C=C1)NC2=C(C=C(C=C2)N3CCCCC3)F)[NH]4,ZYHQUNJXYIKDGO-UHFFFAOYSA-N
|
| 32705 |
+
E4E5F493B2E42512_98D8939FE961DE26_7022_UN,C1(=CC(=CC=C1)OC2CCCC2)OC3=C(C=C(C)C=C3C)[S](=O)(=O)Cl,GTUSERNBSKZWRW-UHFFFAOYSA-N
|
| 32706 |
+
E68E9C2B2FFC6E4F_51106CFC8F3C808B_6041_DP,OC(=O)C[N]1C=NC2=C1N=CN=C2NC[C@@]3(C[C@@H](C(OC)=O)C3)OC,SOHPOBCTFDPGLE-DXPFQBAHSA-N
|
| 32707 |
+
E97986599F40F2AB_8CAE007D7B15CABC_6034_UN,O[S](=O)(=O)C2=NC1=C(C=C(C=C1)Cl)N2CC3(CC3)[N]4C=C(Br)C=N4,KYJOJRWELJICMO-UHFFFAOYSA-N
|
| 32708 |
+
EA7FAB63107DB338_DF2223739ECBCACC_6026_UN,CC1=C(C(=CC(=C1)[N](=O)=O)[S](=O)(=O)N3CCN(C2=C(F)C=CC=N2)CC3)Cl,UMVNEUUJHQJBSG-UHFFFAOYSA-N
|
| 32709 |
+
EBE22DC409A30D1A_6E96875A03359541_6034_UN,COC1=CC(=CC=C1)NC3=C2N(C=NC2=NC(=N3)Cl)C[C@@H](C(OCC)=O)N,YWDHOFLQGOZMSM-LBPRGKRZSA-N
|
| 32710 |
+
EC3C4661B5C69BB9_19C454BB5B97FC92_6038_DP,CCOC(=O)C4=C(NC(C2ON=C(C1CNC1)C2)=O)C3=C(C=CC=C3F)[N]4C,HEKSVAUXBRBEAP-UHFFFAOYSA-N
|
| 32711 |
+
EE72C77EDA3DDDB9_AB420E82AD1D1C72_6041_DP,N1CC(C1)[N]2C=NC3=C2N=CN=C3NC4=CC=CC(=C4F)C(OC)=O,ORSXOCZMWITZDY-UHFFFAOYSA-N
|
| 32712 |
+
F281241E52AA531A_58FCA99F22B5CDEE_6029_UN,CC1=C(C=CC=C1)C4(N[S](C2=CC=C(C=C2)C3CCCC3)(=O)=O)CCCCC4,ZJJZWCHWHGIODE-UHFFFAOYSA-N
|
| 32713 |
+
F86FDA949467AD6F_0121B3CDB46936E1_6029_UN,COC1=CC(=CC=C1)C2=CCN(C2)[S](C4=CC(=C3OCOC3=C4)Cl)(=O)=O,QYDQKPNLCCZHBJ-UHFFFAOYSA-N
|
| 32714 |
+
FA39268B98515760_9BF51B3200F8C622_6038_UN,COCC(NC([C@H]1C(C)(C)[C@H]1C2=N[NH]C(=N2)N)=O)C#N,ZRGQYUBZWBHJGW-VVXQKDJTSA-N
|
| 32715 |
+
FFF3B90010BF0AA5_1F0D63D988EB1701_6029_UN,CC1=CC=C(C=C1)C4CCC(N[S](C2=CC=C(C=C2)OC3CC3)(=O)=O)CC4,XHKOIBZNIPVPBX-UHFFFAOYSA-N
|
| 32716 |
+
rxn:1:43039:4526,CC(C)(C)C1CCC(C(=O)NCc2cn(CC#Cc3cnc(Cl)c(C(=O)O)c3)nn2)CC1,HWFNUHYKAKLJTA-UHFFFAOYSA-N
|
| 32717 |
+
rxn:1:45249:17843,CC(C)C1C(=O)Nc2c(-c3cn(CCC#Cc4ccnc(Cl)c4Cl)nn3)cc(C(=O)C3CCCCC3)cc21,ALJUUYQIFUUHDZ-UHFFFAOYSA-N
|
| 32718 |
+
rxn:1:48073:17807,CCC(=O)c1cc(-c2cn(CC(O)C(O)c3c(C)ccc4c3C(=O)C(=O)N4)nn2)c2c(c1)C(C)(C)C(=O)N2,XGPICSHJDYPMED-UHFFFAOYSA-N
|
| 32719 |
+
rxn:1:48205:17788,CC(C)C(=O)c1cc(-c2cn(CC(O)C(O)c3ccnc(Cl)c3F)nn2)c2c(c1)C1(CCCC1)C(=O)N2,CLLKDRQFCJXZMB-UHFFFAOYSA-N
|
| 32720 |
+
rxn:1:50062:17848,CCCC1C(=O)Nc2c(-c3cn(CC4C(c5cccc(OC)n5)C4(F)F)nn3)cc(C(=O)C3CCC3)cc21,JVUSHMYPMKQFLO-UHFFFAOYSA-N
|
| 32721 |
+
rxn:1:50171:24926,CCC(=O)Nc1ccc(N2CC(c3cn(CC4C(c5ccc(OC)c(O)c5)C4(F)F)nn3)CC2=O)cc1,SSXBVRDLQLFNIL-UHFFFAOYSA-N
|
| 32722 |
+
rxn:1:50538:17843,CC(C)C1C(=O)Nc2c(-c3cn(CC4C(c5cnc6[nH]ccc6n5)C4(F)F)nn3)cc(C(=O)C3CCCCC3)cc21,BDTSEHXXTAVQNS-UHFFFAOYSA-N
|
| 32723 |
+
rxn:1:50609:8284,CC1(c2cc(O)[nH]n2)CCCN(C(=O)c2cn(CC3C(c4ccc5c(c4)CC(=O)N5)C3(F)F)nn2)C1,QYOBZPGXWBHELL-UHFFFAOYSA-N
|
| 32724 |
+
rxn:1:50658:8285,CC1(c2cc(O)[nH]n2)CCN(C(=O)c2cn(CC3C(c4ccc(C(=O)O)cc4F)C3(F)F)nn2)CC1,WPOWZQXFXDUVIB-UHFFFAOYSA-N
|
| 32725 |
+
rxn:1:50787:33655,CCN1CCC(C(=O)Nc2cncc(-c3cn(CC4C(c5cnc(C(=O)OC)nc5)C4(F)F)nn3)c2)CC1,MKGZQNVNNXSFEN-UHFFFAOYSA-N
|
| 32726 |
+
rxn:1:50872:8217,CNc1nccnc1C1CCN(C(=O)c2cn(CC3C(c4cccnc4C(=O)OC)C3(F)F)nn2)CC1,GBDISTZJSZHADE-UHFFFAOYSA-N
|
| 32727 |
+
rxn:1:50880:33655,CCN1CCC(C(=O)Nc2cncc(-c3cn(CC4C(c5cc(C(=O)OC)ccn5)C4(F)F)nn3)c2)CC1,UGGASWYKJKUEBB-UHFFFAOYSA-N
|
| 32728 |
+
rxn:1:51042:25111,CNC(=O)c1ccc(N2CC(c3cn(CC4C(c5ccc(OC)c(C(=O)O)c5)C4(F)F)nn3)CC2=O)cc1,VJABPUODHIVPNA-UHFFFAOYSA-N
|
| 32729 |
+
rxn:1:51063:8285,COc1ccc(C2C(Cn3cc(C(=O)N4CCC(C)(c5cc(O)[nH]n5)CC4)nn3)C2(F)F)c(C(=O)O)c1,JZRYAVHXWYOQSG-UHFFFAOYSA-N
|
| 32730 |
+
rxn:1:51355:22767,Nc1c(Br)c(C2CCCCC2)nn1-c1cncc(-c2cn(CC3C(c4ccc(F)c(C=CC(=O)O)c4)C3(F)F)nn2)c1,UVYNVBHSFOPGSD-UHFFFAOYSA-N
|
| 32731 |
+
rxn:1:53845:35459,CCCC1CCN(C(=O)c2ccc(-c3cn(CCC4C(c5cnc(O)c(O)c5)C4(F)F)nn3)c(C)c2)CC1,CNDKAYRQQDKSKU-UHFFFAOYSA-N
|
| 32732 |
+
rxn:1:53969:25111,CNC(=O)c1ccc(N2CC(c3cn(CCC4C(c5ccc(OC)c(O)c5)C4(F)F)nn3)CC2=O)cc1,KQHCCBWGVMWFAG-UHFFFAOYSA-N
|
| 32733 |
+
rxn:1:54100:33216,CN1CCC(CC(=O)Nc2ncc(Br)cc2-c2cn(CCC3C(c4cnc(C(=O)O)nc4)C3(F)F)nn2)CC1,WCFOTKMKDRSVGQ-UHFFFAOYSA-N
|
| 32734 |
+
rxn:1:54262:17788,CC(C)C(=O)c1cc(-c2cn(CCC3C(c4ccc5[nH]ncc5c4)C3(F)F)nn2)c2c(c1)C1(CCCC1)C(=O)N2,YVVROCOVNUZARA-UHFFFAOYSA-N
|
| 32735 |
+
rxn:1:54769:17843,CC(C)C1C(=O)Nc2c(-c3cn(CCC4C(c5ccc6cnc(O)cc6c5)C4(F)F)nn3)cc(C(=O)C3CCCCC3)cc21,FJVYDYQUOLQZJW-UHFFFAOYSA-N
|
| 32736 |
+
rxn:1:54776:17788,CC(C)C(=O)c1cc(-c2cn(CCC3C(c4cnc(N5CCCC5)nc4)C3(F)F)nn2)c2c(c1)C1(CCCC1)C(=O)N2,YMGNEHGKBXHHCB-UHFFFAOYSA-N
|
| 32737 |
+
rxn:1:54776:22483,CC(=O)N(Cc1cn(CCC2C(c3cnc(N4CCCC4)nc3)C2(F)F)nn1)c1cccc(C(=O)O)c1,LJRGGSNQFCLUHI-UHFFFAOYSA-N
|
| 32738 |
+
rxn:1:59804:24598,Cc1ccccc1C[C@@H](C(=O)O)N1CC(c2cn(C3CCN(C(=O)c4ccc(=O)n(C)n4)CC3)nn2)CC1=O,DHICPWCXXBNVTD-BVHINDKJSA-N
|
| 32739 |
+
rxn:1:60317:34723,COc1ccc(C=CC(=O)N2CCC(n3cc(COc4ccc(C=C5C(=O)ON=C5C)cc4Br)nn3)CC2)cc1,LNQUHAIBQIKJKN-UHFFFAOYSA-N
|
| 32740 |
+
rxn:1:62645:17807,CCC(=O)c1cc(-c2cn(CC3CC(=O)N(C(C)C(=O)O)C3)nn2)c2c(c1)C(C)(C)C(=O)N2,KVOLPDCHHRTDFZ-UHFFFAOYSA-N
|
| 32741 |
+
rxn:1:62648:24721,CC(C)(C)C(c1ccccc1)N1CC(Cn2cc(C3CC(=O)N([C@@H](CS)C(=O)O)C3)nn2)CC1=O,DJSVPKKOTAVFAC-ZQXYWMNUSA-N
|
| 32742 |
+
rxn:1:62972:8005,CC(=O)c1ccccc1N1CC(Cn2cc(C(=O)N3CCN(Cc4nc5ccccc5c(=O)[nH]4)CC3)nn2)CC1=O,QCUFUEIOKBBVKC-UHFFFAOYSA-N
|
| 32743 |
+
rxn:1:63055:29382,CCn1cc(N2CC(Cn3cc(-c4ccccc4C(=O)N4CCC(C(F)(F)F)CC4)nn3)CC2=O)cn1,HCKQHTBJGHUDSS-UHFFFAOYSA-N
|
| 32744 |
+
rxn:1:63095:26049,CNC(=O)c1cccc(N2CC(Cn3cc(C4CC(=O)N(CCC[Si](O)(O)O)C4)nn3)CC2=O)c1,YXZCVRZDYHPJDO-UHFFFAOYSA-N
|
| 32745 |
+
rxn:1:63260:33381,COc1ccc(O)c(N2CC(Cn3cc(CN4C(=O)SC(=Cc5ccc(OC)c(I)c5)C4=O)nn3)CC2=O)c1,IEJIVYQNNPGDMK-UHFFFAOYSA-N
|
| 32746 |
+
rxn:1:63305:13496,COc1ccncc1N1CC(Cn2cc(CN3C(=O)SC(=Cc4cc(Br)cc(OC)c4O)C3=O)nn2)CC1=O,CKRNVHURTXIMDC-UHFFFAOYSA-N
|
| 32747 |
+
rxn:1:63365:33381,COc1cc(N2CC(Cn3cc(CN4C(=O)SC(=Cc5ccc(OC)c(I)c5)C4=O)nn3)CC2=O)ccn1,MIRNJIBTITYOTM-UHFFFAOYSA-N
|
| 32748 |
+
rxn:1:63400:24555,CCC(c1cccnc1)N1CC(c2cn(CC3CC(=O)N(c4ccccc4C#C[Si](C)(C)C)C3)nn2)CC1=O,WBCVEOQOLDPIBI-UHFFFAOYSA-N
|
| 32749 |
+
rxn:1:63400:25443,CSc1ccccc1N1CC(c2cn(CC3CC(=O)N(c4ccccc4C#C[Si](C)(C)C)C3)nn2)CC1=O,BFDCIFDCXZDJTB-UHFFFAOYSA-N
|
| 32750 |
+
rxn:1:63595:10795,COc1ccc(OC)c(C=C2SC(=O)N(Cc3cn(CC4CC(=O)N(c5ccc(C)c(Br)c5)C4)nn3)C2=O)c1,TUVHYKWBANAKRQ-UHFFFAOYSA-N
|
| 32751 |
+
rxn:1:63960:33119,Cc1cc(C(=O)NCC(C)(C)C)ccc1-c1cn(CC2CC(=O)N(C3(C(=O)O)CC3)C2)nn1,XAKCVZQWSYVOKC-UHFFFAOYSA-N
|
| 32752 |
+
rxn:1:65500:20644,O=C(Nc1ccc(F)cc1F)NC1(c2cn(CC3CC(=O)N(c4cc(O)c5ccccc5n4)C3)nn2)CCCCC1,BLQROTZDCKNYQC-UHFFFAOYSA-N
|
| 32753 |
+
rxn:2:102040:144460,CCC(NC1CCN(c2n[nH]c(=O)[nH]c2=O)C1)c1cccc(C2C(CSC(C)=O)C2(F)F)c1,MHFOLBHJVVJDGN-UHFFFAOYSA-N
|
| 32754 |
+
rxn:2:104232:141967,CC1(C)C(C[Si](C)(C)C)CC1NCC(c1ccccc1)C1CCCCC1,YMQMTXXDJCCXKF-UHFFFAOYSA-N
|
| 32755 |
+
rxn:2:111494:148296,CCC1(OC)CCC(NC2CCC(c3ccc(S(C)(=O)=O)cc3)CC2)CC1,WFOYKXJRLDEHPS-UHFFFAOYSA-N
|
| 32756 |
+
rxn:2:115446:84154,CCOC1CN(c2ccc(NC(C)c3ccc(N4CCN(C)CC4)cc3)cn2)CC1OC,ROMDDPGQNHAYRR-UHFFFAOYSA-N
|