basic_info |
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Product_Name: | AKR 501 |
CAS: | 570406-98-3 |
EnglishSynonyms: | AKR 501 ; 1-(3-CHLORO-5-([4-(4-CHLOROTHIOPHEN-2-YL)-5-(4-CYCLOHEXYLPIPERAZIN-1-YL)-1,3-THIAZOL-2-YL]CARBAMOYL)PYRIDIN-2-YL)PIPERIDINE-4-CARBOXYLIC ACID |
pro_mdlNumber: | MFCD18633249 |
pro_acceptors: | 9 |
pro_donors: | 2 |
pro_smile: | c1c(cnc(c1Cl)N2CCC(CC2)C(=O)O)C(=O)Nc3nc(c(s3)N4CCN(CC4)C5CCCCC5)c6cc(cs6)Cl |
InChi: | InChI=1S/C29H34Cl2N6O3S2/c30-20-15-23(41-17-20)24-27(37-12-10-35(11-13-37)21-4-2-1-3-5-21)42-29(33-24)34-26(38)19-14-22(31)25(32-16-19)36-8-6-18(7-9-36)28(39)40/h14-18,21H,1-13H2,(H,39,40)(H,33,34,38) |
InChiKey: | InChIKey=OFZJKCQENFPZBH-UHFFFAOYSA-N |
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