COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL016501
Chemical Name: 2-amino-4-(3,4-dimethoxyphenyl)-5,7-dioxo-6-[3-(trifluoromethyl)phenyl]-4,4a,5,6,7,7a-hexahydrothiopyrano[2,3-c]pyrrole-3-carbonitrile
Smiles: N#CC1=C(N)SC2C(C1c1ccc(c(c1)OC)OC)C(=O)N(C2=O)c1cccc(c1)C(F)(F)F

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Molecular Weight: 489.47
Empirical Formula: C23H18F3N3O4S

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 4.51
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 130
Number of rings: 4

     

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