UCSF

ZINC04168343

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 27 Yes

Popular Name: N-(2-fluorophenyl)-5-hydroxy-2-methyl-4-(2-thienyl)-4,6,7,8-tetrahydroquinoline-3-carboxamide N-(2-fluorophenyl)-5-hydroxy-2-m…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.91 -2.44 -13.99 1 4 0 58 382.46 3 ↓
Mid Mid (pH 6-8) 4.08 -4.2 -10.42 1 4 0 58 382.46 3 ↓

Activity (Go SEA)

Rings

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.