UCSF

ZINC20244579

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 21 Yes

Popular Name: (2R)-2-[(2,4-dioxo1H-pyrimidine-5-carbonyl)amino]-3-(1H-imidazol-4-yl)propanoic (2R)-2-[(2,4-dioxo1H-pyrimidine-…

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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) -3.91 0.9 -66.95 5 10 0 165 293.239 5 ↓
Hi High (pH 8-9.5) -3.46 -1.44 -96 3 10 -2 167 291.223 5 ↓
Hi High (pH 8-9.5) -3.46 -0.99 -107.93 3 10 -2 167 291.223 5 ↓
Mid Mid (pH 6-8) -3.91 0.46 -57.97 4 10 -1 164 292.231 5 ↓
Mid Mid (pH 6-8) -3.91 0.92 -65.31 4 10 -1 164 292.231 5 ↓

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

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