COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK134773
Chemical Name: 3-(3,4-dimethoxyphenyl)-10-hexanoyl-11-[4-(trifluoromethyl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCCCC(=O)N1c2ccccc2NC2=C(C1c1ccc(cc1)C(F)(F)F)C(=O)CC(C2)c1ccc(c(c1)OC)OC

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Molecular Weight: 592.66
Empirical Formula: C34H35F3N2O4

Physical State: Dry powder
Available Amount: 56 mg

Lipinsky:
logP: 6.91
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 5

     

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