UCSF

ZINC42093807

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2010 17 No

Popular Name: 1-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]pyrrolidine-2,5-dione 1-[[methyl-[(1-methylpyrazol-4-y…

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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) -0.82 2.47 -13 0 6 0 58 236.275 4 ↓
Lo Low (pH 4.5-6) -0.82 4.87 -39.46 1 6 1 60 237.283 4 ↓

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

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