UCSF

ZINC70200137

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2011 18 No

Popular Name: 5-(1,3-dioxopyrrolo[3,4-c]pyridin-2-yl)pentanoic 5-(1,3-dioxopyrrolo[3,4-c]pyridi…

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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) 0.41 5.24 -49.78 0 6 -1 92 247.23 5 ↓
Lo Low (pH 4.5-6) 0.41 3.27 -11.27 1 6 0 89 248.238 5 ↓

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

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