COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK958497
Chemical Name: 2-{[(2Z)-3-(4-nitrophenyl)prop-2-enoyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Smiles: O=C(Nc1sc2c(c1C(=O)N)CCCCCC2)/C=C\c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 399.47
Empirical Formula: C20H21N3O4S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 6.396
Rotatable bonds: 2
H-donors: 3
H-acceptors: 4
PSA: 146
Number of rings: 3

     

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