UCSF

ZINC04673796

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 27th, 2005 31 Yes

Popular Name: 2-phenoxyethyl 2-methyl-4-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate 2-phenoxyethyl 2-methyl-4-(4-met…

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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) 5.46 1.19 -22.88 0 5 0 64 417.505 7 ↓
Mid Mid (pH 6-8) 5.65 0.05 -21.18 0 5 0 64 417.505 7 ↓

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

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