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Drug Details

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Name:CHEMBL210793
PubChem ID:44412127
Pathway:Show KEGG pathways
InChI:InChI=1S/C44H59N7O11S/c1-4-25(2)38(51-42(59)37(24-63)46-26(3)52)43(60)49-35(22-28-10-16-31(54)17-11-28)40(57)47-33(7-5-6-20-45)39(56)48-34(21-27-8-14-30(53)15-9-27)41(58)50-36(44(61)62)23-29-12-18-32(55)19-13-29/h8-19,25,33-38,53-55,63H,4-7,20-24,45H2,1-3H3,(H,46,52)(H,47,57)(H,48,56)(H,49,60)(H,50,58)(H,51,59)(H,61,62)/t25?,33-,34-,35-,36-,37-,38-/m0/s1
SMILES:NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@H](C(CC)C)NC(=O)[C@@H](NC(=O)C)CS)Cc1ccc(cc1)O

Properties:
Formula:C44H59N7O11SAtoms:63
Molecular Weight:894.045Rotatable Bonds:31
H-bond Acceptors:19H-bond Donors:12
logP:3.9952
Targets:
Synonyms:
CHEBI:448958
CHEMBL210793