COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK949281
Chemical Name: 4-{(1E)-3-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-cyano-3-oxoprop-1-en-1-yl}phenyl4-methylbenzoate
Smiles: N#C/C(=C\c1ccc(cc1)OC(=O)c1ccc(cc1)C)/C(=O)Nc1sc2c(c1C(=O)N)CCCC2

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Molecular Weight: 485.56
Empirical Formula: C27H23N3O4S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 6.972
Rotatable bonds: 3
H-donors: 3
H-acceptors: 4
PSA: 150
Number of rings: 4

     

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