COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK098780
Chemical Name: 11-(3-chlorophenyl)-3,3-dimethyl-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Clc1cccc(c1)C1C2=C(Nc3c(N1C(=O)C(C)C)cccc3)CC(CC2=O)(C)C

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Molecular Weight: 422.95
Empirical Formula: C25H27ClN2O2

Physical State: Dry powder
Available Amount: 411 mg

Lipinsky:
logP: 5.317
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 49
Number of rings: 4

     

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