COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565163
Chemical Name: 1-{1-hydroxy-11-(4-methoxyphenyl)-3-[4-(trifluoromethyl)phenyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}hexan-1-one
Smiles: CCCCCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2ccc(cc2)C(F)(F)F)C1c1ccc(cc1)OC

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Molecular Weight: 562.63
Empirical Formula: C33H33F3N2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.951
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 5

     

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