COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL021013
Chemical Name: 2-({(2E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: N#C/C(=C\c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/C(=O)Nc1sc2c(c1C(=O)N)CCC(C2)C

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Molecular Weight: 476.51
Empirical Formula: C24H20N4O5S

Physical State: Dry powder
Available Amount: 360 mg

Lipinsky:
logP: 6.572
Rotatable bonds: 4
H-donors: 3
H-acceptors: 5
PSA: 183
Number of rings: 4

     

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