UCSF

ZINC62153000

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 26th, 2011 14 Yes

Popular Name: 2-[(2S)-pyrrolidin-2-yl]-3H-imidazo[4,5-c]pyridine 2-[(2S)-pyrrolidin-2-yl]-3H-imid…

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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) 0.58 2.52 -41.61 3 4 1 58 189.242 1 ↓
Hi High (pH 8-9.5) 0.58 1.3 -7.07 2 4 0 54 188.234 1 ↓
Mid Mid (pH 6-8) 0.58 1.81 -33.58 2 4 0 56 188.234 1 ↓
Lo Low (pH 4.5-6) 0.58 2.86 -107.76 4 4 2 59 190.25 1 ↓

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

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