COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK443928
Chemical Name: (2Z)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-[1-(2,4-dichlorobenzyl)-1H-pyrrol-2-yl]prop-2-enamide
Smiles: N#C/C(=C/c1cccn1Cc1ccc(cc1Cl)Cl)/C(=O)NCc1ccc2c(c1)OCO2

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Molecular Weight: 454.31
Empirical Formula: C23H17Cl2N3O3

Physical State: Dry powder
Available Amount: 555 mg

Lipinsky:
logP: 4.665
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 76
Number of rings: 4

     

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