PDB CCD ID: | BM9 | ||||||||||||
Number of entries in BioLiP: | 1 | ||||||||||||
Chemical formula: | C25 H34 N6 O5 S | ||||||||||||
InChI: | InChI=1S/C25H34N6O5S/c26-25(27)30-11-3-7-19(15-30)23(33)28-14-20-8-4-12-31(20)24(34)22(16-32)29-37(35,36)21-10-9-17-5-1-2-6-18(17)13-21/h1-2,5-6,9-10,13,19-20,22,29,32H,3-4,7-8,11-12,14-16H2,(H3,26,27)(H,28,33)/t19-,20-,22-/m0/s1 | ||||||||||||
InChIKey: | JWNJPEKBZMEXIU-ONTIZHBOSA-N | ||||||||||||
SMILES: |
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Name: | [S-(R*,R*)]-1-(AMINOIMINOMETHYL)-N-[[1-[N-[(2-NAPHTHALENYLSULFONYL)-L-SERYL]-3-PYRROLIDINYL]METHYL]-3-PIPERIDENECARBOXA MIDE; BMS-189090 | ||||||||||||
ChEMBL: | CHEMBL138877 | ||||||||||||
ZINC: | ZINC000003831647 |