COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183670
Chemical Name: (2E)-3-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(n(c1C)c1ccc2c(c1)OCO2)C)/C(=O)Nc1ccc(cc1)O

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Molecular Weight: 401.42
Empirical Formula: C23H19N3O4

Physical State: Dry powder
Available Amount: 335 mg

Lipinsky:
logP: 4.284
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 96
Number of rings: 4

     

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