In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 21 | Yes |
Popular Name: 1-(3-methylbut-2-enyl)-N-[2-(4-methyl-1-piperidyl)ethyl]piperidin-4-amine 1-(3-methylbut-2-enyl)-N-[2-(4-m…
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) | 3.37 | 8.63 | -117.57 | 3 | 3 | 2 | 24 | 295.515 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.37 | 10.94 | -202.67 | 4 | 3 | 3 | 25 | 296.523 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.