COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK134785
Chemical Name: 11-(4-butoxyphenyl)-3,3-dimethyl-10-(phenylacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCCOc1ccc(cc1)C1C2=C(Nc3c(N1C(=O)Cc1ccccc1)cccc3)CC(CC2=O)(C)C

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Molecular Weight: 508.66
Empirical Formula: C33H36N2O3

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 7.159
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 58
Number of rings: 5

     

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