COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL435826
Chemical Name: 2-amino-4-(2,5-dimethyl-3-{[3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}phenyl)-1-(4-fluorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(cc2)F)C2=C(C1c1cc(C)cc(c1C)Cn1ccc(n1)C(F)(F)F)C(=O)CC(C2)(C)C

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Molecular Weight: 563.6
Empirical Formula: C31H29F4N5O

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.06
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 87
Number of rings: 5

     

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