UCSF

ZINC32829062

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 10th, 2009 28 Yes

Popular Name: [6-[[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-yl-ethyl]amino]-3-pyridyl]-pyrrolidin-1-yl-methanone [6-[[(2R)-2-(2-chlorophenyl)-2-p…

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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) 2.91 10.93 -46.2 2 5 1 50 399.946 6 ↓
Lo Low (pH 4.5-6) 2.91 11.38 -108.89 3 5 2 51 400.954 6 ↓

Activity (Go SEA)

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