UCSF

ZINC65165781

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 5th, 2011 28 Yes

Popular Name: 4-[[benzyl(4-methoxybutyl)amino]methyl]-7-methoxy-chromen-2-one 4-[[benzyl(4-methoxybutyl)amino]…

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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) 3.70 9.08 -12.4 0 5 0 52 381.472 10 ↓
Mid Mid (pH 6-8) 3.70 11.2 -57.13 1 5 1 53 382.48 10 ↓

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

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