COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK363845
Chemical Name: 3-(1,3-benzodioxol-5-yl)-11-[4-(trifluoromethyl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CC(CC2=C1C(Nc1c(N2)cccc1)c1ccc(cc1)C(F)(F)F)c1ccc2c(c1)OCO2

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Molecular Weight: 478.47
Empirical Formula: C27H21F3N2O3

Physical State: Dry powder
Available Amount: 407 mg

Lipinsky:
logP: 4.476
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 59
Number of rings: 6

     

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