UCSF

ZINC62800406

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2011 20 No

Popular Name: 4-[2-(2-methylimidazol-1-yl)ethoxy]indan-1-one 4-[2-(2-methylimidazol-1-yl)etho…

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Download: MOL2 SDF SMILES Flexibase

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) 1.57 6.46 -37.03 2 5 1 61 272.328 4 ↓
Mid Mid (pH 6-8) 1.57 5.99 -10.79 1 5 0 60 271.32 4 ↓

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

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