COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK086999
Chemical Name: 3-(4-tert-butylphenyl)-11-(furan-2-yl)-10-hexanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCCCC(=O)N1c2ccccc2NC2=C(C1c1ccco1)C(=O)CC(C2)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 510.68
Empirical Formula: C33H38N2O3

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 7.45
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 5

     

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