COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK522756
Chemical Name: 4-{(1E)-2-cyano-3-[(2,5-dimethylphenyl)amino]-3-oxoprop-1-en-1-yl}phenyl4-methylbenzoate
Smiles: N#C/C(=C\c1ccc(cc1)OC(=O)c1ccc(cc1)C)/C(=O)Nc1cc(C)ccc1C

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Molecular Weight: 410.47
Empirical Formula: C26H22N2O3

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 6.137
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 79
Number of rings: 3

     

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