UCSF

ZINC40772003

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2010 21 Yes

Popular Name: N-[(R)-cyclopropyl(p-tolyl)methyl]-2-(4-methyl-1-piperidyl)ethanamine N-[(R)-cyclopropyl(p-tolyl)methy…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 4.18 9.33 -38.38 2 2 1 20 287.471 6 ↓
Mid Mid (pH 6-8) 4.18 10.5 -35.17 2 2 1 16 287.471 6 ↓
Lo Low (pH 4.5-6) 4.18 11.57 -121.76 3 2 2 21 288.479 6 ↓

Activity (Go SEA)

Rings

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