UCSF

ZINC55073677

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2010 26 Yes

Popular Name: 6-(3-allyl-5-ethoxy-4-hydroxy-phenyl)-3,7-dihydro-1H-imidazo[4,5-f]benzimidazol-2-one 6-(3-allyl-5-ethoxy-4-hydroxy-ph…

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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) 3.33 3.98 -13.06 4 7 0 107 350.378 5 ↓
Lo Low (pH 4.5-6) 3.33 4.4 -42.12 5 7 1 108 351.386 5 ↓

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

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