COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK182495
Chemical Name: methyl4-(3-{(1Z)-2-cyano-3-[(4-fluorophenyl)amino]-3-oxoprop-1-en-1-yl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=C(\C(=O)Nc1ccc(cc1)F)/C#N

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Molecular Weight: 417.44
Empirical Formula: C24H20FN3O3

Physical State: Dry powder
Available Amount: 221 mg

Lipinsky:
logP: 5.591
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 84
Number of rings: 3

     

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