UCSF

ZINC36132041

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 18 Yes

Popular Name: 6-[(2R)-2-(3-pyridyl)pyrrolidin-1-yl]pyridin-3-amine 6-[(2R)-2-(3-pyridyl)pyrrolidin-…

Find On: PubMed — Wikipedia — Google

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) 1.54 5.82 -27.91 3 4 1 56 241.318 2 ↓
Mid Mid (pH 6-8) 1.54 5.42 -8.68 2 4 0 55 240.31 2 ↓
Lo Low (pH 4.5-6) 1.54 6.28 -79.09 4 4 2 58 242.326 2 ↓

Activity (Go SEA)

Rings

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