UCSF

ZINC65563808

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 20th, 2011 19 Yes

Popular Name: 3-methyl-2-[(6-pyrrolidin-1-yl-3-pyridyl)amino]-4H-imidazol-5-one 3-methyl-2-[(6-pyrrolidin-1-yl-3…

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Download: MOL2 SDF SMILES Flexibase

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) 0.69 6.63 -16.18 1 6 0 61 259.313 3 ↓
Mid Mid (pH 6-8) 0.69 7.08 -40.25 2 6 1 62 260.321 3 ↓

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

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