UCSF

ZINC04066064

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2005 36 No

Popular Name: pentyl 4-[4-(benzyloxy)-3-methoxyphenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate pentyl 4-[4-(benzyloxy)-3-methox…

Find On: PubMed — Wikipedia — Google

Other Names:

MFCD00753052

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 6.61 1.39 -11.28 0 6 0 74 489.612 11 ↓
Mid Mid (pH 6-8) 6.80 0.29 -12.74 0 6 0 74 489.612 11 ↓
Mid Mid (pH 6-8) 6.61 1.2 -15 0 6 0 74 489.612 11 ↓

Activity (Go SEA)

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