COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183616
Chemical Name: (2E)-3-(1-{4-[(2-chlorobenzyl)oxy]phenyl}-2,5-dimethyl-1H-pyrrol-3-yl)-2-cyano-N-(4-methoxybenzyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(n(c1C)c1ccc(cc1)OCc1ccccc1Cl)C)/C(=O)NCc1ccc(cc1)OC

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Molecular Weight: 526.03
Empirical Formula: C31H28ClN3O3

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 6.961
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 76
Number of rings: 4

     

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