COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK019182
Chemical Name: 4-[3-(4-fluorophenyl)-10-hexanoyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzonitrile
Smiles: CCCCCC(=O)N1c2ccccc2NC2=C(C1c1ccc(cc1)C#N)C(=O)CC(C2)c1ccc(cc1)F

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Molecular Weight: 507.61
Empirical Formula: C32H30FN3O2

Physical State: Dry powder
Available Amount: 114 mg

Lipinsky:
logP: 6.089
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 73
Number of rings: 5

     

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