COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK545402
Chemical Name: 3-(4-tert-butylphenyl)-11-(4-fluorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Fc1ccc(cc1)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 440.56
Empirical Formula: C29H29FN2O

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.783
Rotatable bonds: 0
H-donors: 2
H-acceptors: 1
PSA: 41
Number of rings: 5

     

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