COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040353
Chemical Name: {1-hydroxy-3,3-dimethyl-11-[4-(trifluoromethyl)phenyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}(phenyl)methanone
Smiles: OC1=C2C(=Nc3c(N(C2c2ccc(cc2)C(F)(F)F)C(=O)c2ccccc2)cccc3)CC(C1)(C)C

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Molecular Weight: 490.52
Empirical Formula: C29H25F3N2O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.149
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 5

     

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