UCSF

ZINC22767798

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 23 Yes

Popular Name: 5-(3-imidazol-1-ylpropylamino)-1,3-dimethyl-pyrido[3,2-e]pyrimidine-2,4-dione 5-(3-imidazol-1-ylpropylamino)-1…

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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) -0.40 7.57 -14.98 1 8 0 87 314.349 5 ↓
Mid Mid (pH 6-8) -0.40 8.05 -42.47 2 8 1 88 315.357 5 ↓
Lo Low (pH 4.5-6) -4.13 8.34 -89.43 3 8 2 90 316.365 5 ↓

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

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