COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK074229
Chemical Name: 10-acetyl-3-(4-tert-butylphenyl)-11-(2-chlorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CC(CC2=C1C(N(C(=O)C)c1c(N2)cccc1)c1ccccc1Cl)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 499.05
Empirical Formula: C31H31ClN2O2

Physical State: Dry powder
Available Amount: 174 mg

Lipinsky:
logP: 6.759
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 49
Number of rings: 5

     

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