COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK262173
Chemical Name: 10-[(6-chloropyridin-3-yl)methyl]-3,3-dimethyl-11-(3-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Clc1ccc(cn1)CN1c2ccccc2NC2=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CC(C2)(C)C

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Molecular Weight: 488.97
Empirical Formula: C27H25ClN4O3

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 4.489
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 91
Number of rings: 5

     

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