UCSF

ZINC52631579

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2010 16 Yes

Popular Name: N-isopropyl-4-[(1S,3R)-3-methylcyclohexoxy]butan-1-amine N-isopropyl-4-[(1S,3R)-3-methylc…

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) 3.21 7.63 -35.43 2 2 1 26 228.4 7 ↓

Activity (Go SEA)

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