COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL509536
Chemical Name: 4-{2-[7-bromo-5-(2-chlorophenyl)-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl]ethoxy}-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)OCCN1C(=O)CN=C(c2c1ccc(c2)Br)c1ccccc1Cl

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Molecular Weight: 493.74
Empirical Formula: C21H18BrClN2O5

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 2.882
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 96
Number of rings: 3

     

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