COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK671320
Chemical Name: 2-amino-3,3-dicyano-4-[3-(trifluoromethyl)phenyl]-3,4,4a,5,6,7-hexahydronaphthalene-1-carboxylicacid
Smiles: N#CC1(C#N)C(c2cccc(c2)C(F)(F)F)C2CCCC=C2C(=C1N)C(=O)O

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Molecular Weight: 387.36
Empirical Formula: C20H16F3N3O2

Physical State: Dry powder
Available Amount: 42 mg

Lipinsky:
logP: 4.097
Rotatable bonds: 3
H-donors: 3
H-acceptors: 2
PSA: 110
Number of rings: 3

     

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