UCSF

ZINC05690397

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2006 19 Yes

Popular Name: 3-Quinolinecarboxamide, 1,2-dihydro-N-butyl-4-hydroxy-2-oxo-; BRN 4322042; LS-141414; N-Butyl-4-hydroxy-2-oxo-1,2-dihydro-3-quinolinecarboxamide 3-Quinolinecarboxamide, 1,2-dihy…

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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) 1.34 4.26 -50.72 2 5 -1 85 259.285 4 ↓
Mid Mid (pH 6-8) 2.19 2.52 -12.51 3 5 0 87 260.293 4 ↓

Activity (Go SEA)

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