COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK379336
Chemical Name: 4-{(1E)-2-cyano-3-[(2,3-dichlorophenyl)amino]-3-oxoprop-1-en-1-yl}phenyl4-bromobenzoate
Smiles: N#C/C(=C\c1ccc(cc1)OC(=O)c1ccc(cc1)Br)/C(=O)Nc1cccc(c1Cl)Cl

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Molecular Weight: 516.18
Empirical Formula: C23H13BrCl2N2O3

Physical State: Dry powder
Available Amount: 162 mg

Lipinsky:
logP: 6.989
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 79
Number of rings: 3

     

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