COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL022371
Chemical Name: 2-{[(2Z)-2-cyano-3-(3-nitrophenyl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: N#C/C(=C/c1cccc(c1)[N+](=O)[O-])/C(=O)Nc1sc2c(c1C(=O)N)CCCC2

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Molecular Weight: 396.43
Empirical Formula: C19H16N4O4S

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 5.041
Rotatable bonds: 3
H-donors: 3
H-acceptors: 4
PSA: 170
Number of rings: 3

     

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