COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK042308
Chemical Name: 7-bromo-5-(2-chlorophenyl)-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-3-yl4-aminobutanoate
Smiles: NCCCC(=O)OC1N=C(c2c(NC1=O)ccc(c2)Br)c1ccccc1Cl

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Saltdata: HBr
Molecular Weight: 450.72
Empirical Formula: C19H17BrClN3O3

Physical State: Dry powder
Available Amount: 1418 mg

Lipinsky:
logP: 3.151
Rotatable bonds: 6
H-donors: 3
H-acceptors: 3
PSA: 93
Number of rings: 3

     

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