COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL438753
Chemical Name: 11-(3,4-dimethoxyphenyl)-3-(4-methylphenyl)-10-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1ccc(cc1OC)C1C2=C(CC(CC2=O)c2ccc(cc2)C)Nc2c(N1C(=O)c1ccccc1)cccc2

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Molecular Weight: 544.65
Empirical Formula: C35H32N2O4

Physical State: Dry powder
Available Amount: 408 mg

Lipinsky:
logP: 6.543
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 6

     

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