Compound List
| Compound | Inchikey | Smiles | Mol |
|---|---|---|---|
|
C1 "ASAP-0036773-001"
|
CCVZZJFVCZKBEW-UHFFFAOYSA-N | CSc1ccccc1CC(=O)N1CCCC(CF)C1 | |
|
C2 "ASAP-0036304-001"
|
DFGLJBPMZPVSMK-UHFFFAOYSA-N | COc1cccc(NC(=O)N2CCCC(C(N)=O)C2)c1Cl | |
|
C3 "ASAP-0037637-001"
|
XCIJOFUOZLCWIY-UHFFFAOYSA-N | NC(=O)C1CCC(=O)N(Cc2cccc(Cl)c2)C1 | |
|
C4 "ASAP-0036545-001"
|
AZKVXQCFORNMSH-UHFFFAOYSA-N | CSc1ccc(Br)cc1CC(=O)N1CCC(C(N)=O)C1 | |
|
C5 "ASAP-0036444-001"
|
VXTCJEPNAMERNR-UHFFFAOYSA-N | NC(=O)C1CCCN(C(=O)C2SCc3cccnc32)C1 | |
|
C6 "Z1491353358"
|
ABNRKDROCBKFEH-UHFFFAOYSA-N | NC1CCN(S(=O)(=O)c2ccccc2)C1 | |
|
C7 "ASAP-0032627-001"
|
VDGDDJZRHZPZCA-UHFFFAOYSA-N | COc1c(C#N)cccc1CC(=O)N1CCCC(C(N)=O)C1 | |
|
C8 "ASAP-0035316-001"
|
YEEQWHOUTZRGAB-UHFFFAOYSA-N | CSc1cccc(CC(=O)N2CCCC(C(N)=O)C2)c1 | |
|
C9 "ASAP-0031604-001"
|
UFYNWTYMVOYUIH-UHFFFAOYSA-N | COCC(C)NC(=O)c1nn(C)c2ccccc12 | |
|
C10 "ASAP-0034429-001"
|
CNYNLJPJLJQEQZ-UHFFFAOYSA-N | COC(C(=O)N1CCCC(C(N)=O)C1)c1ccccc1C | |
|
C11 "ASAP-0032235-001"
|
FSNFOMGLDYESSZ-UHFFFAOYSA-N | C=CS(=O)(=O)N1CCCC(C(N)=O)C1 | |
|
C12 "Z1741968196"
|
LJXQPZWIHJMPQQ-UHFFFAOYSA-N | Nc1ncccn1 | |
|
C13 "ASAP-0036323-001"
|
SHHPINGYNRIYNK-UHFFFAOYSA-N | COc1ccccc1CC(=O)N1CC2(C(N)=O)CCC1C2 | |
|
C14 "ASAP-0032512-001"
|
YUYPXSAJEYKAGG-UHFFFAOYSA-N | COc1ccccc1CC(=O)N1CC(C)C(C(N)=O)C1 | |
|
C15 "ASAP-0035378-001"
|
IFJNGSWSPUXOCR-UHFFFAOYSA-N | CCc1ccccc1CC(=O)N1CCCC(C(N)=O)C1 | |
|
C16 "ASAP-0031953-001"
|
DUAFBFAQMMCFPO-UHFFFAOYSA-N | NC(=O)C1CCCN(C(=O)C2CCNc3[nH]ncc32)C1 | |
|
C17 "ASAP-0034494-001"
|
GPQKHKQSBRCPLG-UHFFFAOYSA-N | COc1cccc(Cl)c1CC(=O)N1CC(C(N)=O)CC(C(=O)NC2CC2)C1 | |
|
C18 "ASAP-0036303-001"
|
QEUIIYABWPSJMA-UHFFFAOYSA-N | CC(C(=O)N1CCCC(C(N)=O)C1)c1nc(F)ccc1Cl | |
|
C19 "ASAP-0032482-001"
|
MSPWRYALONZABD-UHFFFAOYSA-N | COc1ccccc1CC(=O)N1CCC(CC(N)=O)C1 | |
|
C20 "ASAP-0036671-001"
|
ZLXAWJCPNCQXOK-UHFFFAOYSA-N | CSc1ccccc1N(C)C(=O)N1CCCC(C(N)=O)C1 | |
|
C21 "ASAP-0032637-001"
|
XJRJYHVAUXLXKS-UHFFFAOYSA-N | COc1ccccc1CC(=O)N1CC(C(N)=O)CCC1C | |
|
C22 "ASAP-0034482-001"
|
ICZSVGPDCFQROW-UHFFFAOYSA-N | NC(=O)C1CCCN(C(=O)C2CCc3cccc(O)c32)C1 | |
|
C23 "Z1201621547"
|
XLQIGLBALJNHKR-UHFFFAOYSA-N | COC(=O)c1ccncc1N | |
|
C24 "ASAP-0030968-001"
|
DVVWQQZWRTXTMK-UHFFFAOYSA-N | COc1ccc(Cl)c2c1C(=O)C(=O)N2 | |
|
C25 "ASAP-0035344-001"
|
NNZDJLYJDJZVJG-UHFFFAOYSA-N | CC(C)(C)c1ccccc1NC(=O)N1CCCC(C(N)=O)C1 | |
|
C26 "ASAP-0032455-001"
|
SIJSHILCUHKBHW-UHFFFAOYSA-N | NC(=O)C1CCCN(C(=O)Nc2ccccc2F)C1 | |
|
C27 "ASAP-0037607-001"
|
XFDPKKNIFJSWGV-UHFFFAOYSA-N | CSc1ccccc1N1CC(C(N)=O)CCC1=O | |
|
C28 "ASAP-0036580-001"
|
RUITYHVLQKGYIF-UHFFFAOYSA-N | CSc1ccccc1NC(=O)N1CCC(C(N)=O)C1 | |
|
C29 "ASAP-0036798-001"
|
IIOAYFHECFIEIZ-UHFFFAOYSA-N | CSc1ccccc1CC(=O)N1CCCC(O)C1 | |
|
C30 "ASAP-0036788-001"
|
DYNBLKMWIHEGPC-UHFFFAOYSA-N | CSc1ccccc1CC(=O)N1CCc2nccc(O)c2C1 | |
|
C31 "ASAP-0032380-001"
|
AIEHCHWAPRSECY-UHFFFAOYSA-N | Cc1ccccc1NC(=O)N1CCCC(C(N)=O)C1 | |
|
C32 "Z558511008"
|
SNURKZHBZPONJX-UHFFFAOYSA-N | Cn1ccc(NCc2ccccc2)n1 | |
|
C33 "ASAP-0035291-001"
|
JUSCUUOSRYPCRL-UHFFFAOYSA-N | NC(=O)CC1CCCN(c2ncnc3ccccc23)C1 | |
|
C34 "ASAP-0036332-001"
|
QCOUSVMUBLQHPP-UHFFFAOYSA-N | NC(=O)C1CCCN(C(=O)C2(c3ccnn3C(F)(F)F)CC2)C1 | |
|
C35 "ASAP-0032823-001"
|
AGYHXRSAXIDCES-UHFFFAOYSA-N | COc1ccccc1C(NC(=O)OC(C)(C)C)C(=O)N1CCCC(C(N)=O)C1 | |
|
C36 "ASAP-0032819-001"
|
NHPQEFHMDYOTOA-UHFFFAOYSA-N | COc1cccc(Cl)c1CC(=O)N1CCCC(C(N)=O)C1 | |
|
C37 "ASAP-0031591-001"
|
RYIGIXMEYULONZ-UHFFFAOYSA-N | Cc1cc(CNC(=O)c2cn(C)c3ccccc23)on1 | |
|
C38 "Z1415893881"
|
JFGXRDGYMLGBBB-UHFFFAOYSA-N | NC(=O)C1(N)CC1 | |
|
C39 "ASAP-0032437-001"
|
BAWQVTYFUSCRSF-UHFFFAOYSA-N | COc1cccc(Cl)c1NC(=O)N1CCCC(C(N)=O)C1 | |
|
C40 "ASAP-0036379-001"
|
GAJBKOBGGSAGFE-UHFFFAOYSA-N | NC(=O)C1CCCN(C(=O)C(F)(F)c2cnsc2Cl)C1 | |
|
C41 "ASAP-0036484-001"
|
ICAOAIIRHBCCAZ-UHFFFAOYSA-N | Cn1ncc2ccc(CN3CC(C(N)=O)CCC3=O)cc21 | |
|
C42 "Z1741976468"
|
YAMHXTCMCPHKLN-UHFFFAOYSA-N | O=C1NCCN1 | |
|
C43 "ASAP-0032043-001"
|
BNONJNCLVIRUCY-UHFFFAOYSA-N | Cc1cc(C)c(Nc2ccn(C3COC3)n2)c(C)c1 | |
|
C44 "ASAP-0032613-001"
|
VJNDTMIDSGNFJC-UHFFFAOYSA-N | COc1cccnc1CC(=O)N1CCCC(C(N)=O)C1 | |
|
C45 "Z1148747945"
|
DHUDCBCQKIWLSB-UHFFFAOYSA-N | CC(=O)Nc1ccncc1C | |
|
C46 "ASAP-0032426-001"
|
DVNZCRUHPFYGIQ-UHFFFAOYSA-N | Cc1cccc(CNC(=O)N2CCCC(C(N)=O)C2)c1 | |
|
C47 "ASAP-0036725-001"
|
DNENLOCKKIRGNY-UHFFFAOYSA-N | COc1ccc(C(F)(F)F)cc1CC(=O)N1CCSC(C(N)=O)C1 | |
|
C48 "ASAP-0032793-001"
|
RXCDGQVWMAQTNG-UHFFFAOYSA-N | COc1cc(Cl)ccc1CC(=O)N1CCCC(C(N)=O)C1 | |
|
C49 "Z1685106505"
|
OPUWQKONOBGDBJ-UHFFFAOYSA-N | Cn1ccnc1-c1noc(C2CCC2)n1 | |
|
C50 "ASAP-0018764-002"
|
HGZULNNLLFYOFI-UHFFFAOYSA-N | CN(C)S(=O)(=O)c1cccnc1 | |
|
C51 "Z437516460"
|
SQKAEGRLXBUQKF-UHFFFAOYSA-N | Cc1ccc(CNC(=O)C2CCC2)cn1 | |
|
C52 "ASAP-0035417-001"
|
ZCVSMWFZKMVPLV-UHFFFAOYSA-N | NC(=O)C1CCCN(C(=O)Cc2ccccc2CO)C1 | |
|
C53 "ASAP-0032757-001"
|
BAFLNQPOAQUAMV-UHFFFAOYSA-N | COc1ccccc1N(C)C(=O)N1CCCC(C(N)=O)C1 | |
|
C54 "ASAP-0034398-001"
|
IZZURCOVVRSJHS-UHFFFAOYSA-N | COc1ccccc1CCN1CC(C(N)=O)CC1=O | |
|
C55 "ASAP-0036541-001"
|
BWOXLKDHBJDGAX-UHFFFAOYSA-N | COc1ncccc1NS(=O)(=O)N1CCCC(C(N)=O)C1 | |
|
C56 "ASAP-0035288-001"
|
GEUCKEBNKVUUPC-UHFFFAOYSA-N | NC(=O)C1CC(=O)N(Cc2cccc3c2OCC3)C1 | |
|
C57 "ASAP-0034420-001"
|
WDWZKNJCYBSIRL-UHFFFAOYSA-N | COc1ccccc1CC(=O)N1CC(C(N)=O)C(C(F)(F)F)C1 | |
|
C58
|
BBYUVETWVSEHPK-UHFFFAOYSA-N | CC(C(=O)O)C(NC(=O)c1ncnc2ccc12)c1ccc(Br)cc1 |