UCSF

ZINC26004839

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 3rd, 2009 23 Yes

Popular Name: 1-Pyrrolidinepropanamide, N-(2,6-dimethylphenyl)-alpha-1-pyrrolidinyl-; BRN 1398673; LS-138104; N-(2,6-Dimethylphenyl)-alpha-1-pyrrolidinyl-1-pyrrolidinepropanamide 1-Pyrrolidinepropanamide, N-(2,6…

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) 1.83 8 -43.13 2 4 1 37 316.469 5 ↓
Hi High (pH 8-9.5) 1.83 9.87 -31.98 2 4 1 37 316.469 5 ↓
Mid Mid (pH 6-8) 1.83 10.33 -126.31 3 4 2 38 317.477 5 ↓

Activity (Go SEA)

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