COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171797
Chemical Name: 11-[2-(butan-2-yloxy)phenyl]-10-hexanoyl-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCCCC(=O)N1c2ccccc2NC2=C(C1c1ccccc1OC(CC)C)C(=O)CC(C2)(C)C

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Molecular Weight: 488.67
Empirical Formula: C31H40N2O3

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 7.294
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 58
Number of rings: 4

     

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