COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL015227
Chemical Name: (3E)-7-bromo-5-(2-chlorophenyl)-3-(4-methoxybenzylidene)-1,3-dihydro-2H-1,4-benzodiazepin-2-one
Smiles: COc1ccc(cc1)/C=c\1/nc(c2ccccc2Cl)c2c([nH]c1=O)ccc(c2)Br

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Molecular Weight: 467.75
Empirical Formula: C23H16BrClN2O2

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 5.838
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 50
Number of rings: 4

     

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