UCSF

ZINC20896849

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2008 32 Yes

Popular Name: 5-(2,4-dioxo-6-pyrrol-1-yl-1H-pyrimidin-5-yl)-6-(4-ethylphenyl)-1,7-dihydropyrrolo[3,2-e]pyrimidine- 5-(2,4-dioxo-6-pyrrol-1-yl-1H-py…

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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) 2.07 5.46 -21.88 5 10 0 152 430.424 4 ↓
Hi High (pH 8-9.5) 2.99 2.55 -114.25 3 10 -2 158 428.408 4 ↓
Mid Mid (pH 6-8) 2.53 4.32 -50.48 4 10 -1 155 429.416 4 ↓

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