UCSF

ZINC67947143

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 26 Yes

Popular Name: 1-[4-[(2,3-dimethylimidazol-4-yl)methyl]-1-methyl-1,4,9-triazaspiro[5.5]undecan-9-yl]-3-methoxy-prop 1-[4-[(2,3-dimethylimidazol-4-yl…

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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) 0.08 6.95 -92.11 2 7 2 56 365.522 5 ↓
Hi High (pH 8-9.5) 0.08 4.69 -12.06 0 7 0 54 363.506 5 ↓
Mid Mid (pH 6-8) 0.08 5.17 -33.52 1 7 1 55 364.514 5 ↓

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

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