UCSF

ZINC52631568

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2010 14 Yes

Popular Name: N-methyl-4-[(1S,3S)-3-methylcyclohexoxy]butan-1-amine N-methyl-4-[(1S,3S)-3-methylcycl…

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) 2.54 6.4 -36.83 2 2 1 26 200.346 6 ↓

Activity (Go SEA)

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