UCSF

ZINC49235310

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 25th, 2010 20 Yes

Popular Name: 6-[[[(1R)-2-imidazol-1-yl-1-methyl-ethyl]amino]methyl]-1,3-dimethyl-pyrimidine-2,4-dione 6-[[[(1R)-2-imidazol-1-yl-1-meth…

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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) -0.73 6.22 -67.45 2 7 1 78 278.336 5 ↓
Hi High (pH 8-9.5) -0.73 5.29 -17.62 1 7 0 74 277.328 5 ↓
Mid Mid (pH 6-8) -0.73 5.8 -42.52 2 7 1 75 278.336 5 ↓
Lo Low (pH 4.5-6) -0.73 6.73 -129.9 3 7 2 80 279.344 5 ↓

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

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