COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK132739
Chemical Name: (2E)-4-{[3-(4-chlorophenyl)-4-methyl-3H-1,5-benzodiazepin-2-yl]amino}-4-oxobut-2-enoicacid
Smiles: OC(=O)/C=C/C(=O)NC1=Nc2ccccc2N=C(C1c1ccc(cc1)Cl)C

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Molecular Weight: 381.82
Empirical Formula: C20H16ClN3O3

Physical State: Dry powder
Available Amount: 345 mg

Lipinsky:
logP: 1.642
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 91
Number of rings: 3

     

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