COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741729
Chemical Name: 2-(1-{3,3-dimethyl-1-oxo-11-[4-(trifluoromethyl)phenyl]-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}ethylidene)-1H-indene-1,3(2H)-dione
Smiles: O=C1CC(C)(C)CC2=C1C(c1ccc(cc1)C(F)(F)F)N(c1c(N2)cccc1)/C(=C/1\C(=O)c2c(C1=O)cccc2)/C

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Molecular Weight: 556.58
Empirical Formula: C33H27F3N2O3

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 6.617
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 66
Number of rings: 6

     

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