In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 25 | Yes |
Popular Name: N'-[(3R)-1-[(2-allyloxyphenyl)methyl]-3-piperidyl]-N,N,N'-trimethyl-propane-1,3-diamine N'-[(3R)-1-[(2-allyloxyphenyl)me…
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) | 3.12 | 8.33 | -35.75 | 1 | 4 | 1 | 20 | 346.539 | 10 | ↓ |
Lo Low (pH 4.5-6) | 3.12 | 12.88 | -184.15 | 3 | 4 | 3 | 23 | 348.555 | 10 | ↓ |
Lo Low (pH 4.5-6) | 3.12 | 10.62 | -99.39 | 2 | 4 | 2 | 21 | 347.547 | 10 | ↓ |