In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 17 | Yes |
Popular Name: 1-[4-[(3S,5R)-3,5-dimethyl-1-piperidyl]phenyl]-N-methyl-methanamine 1-[4-[(3S,5R)-3,5-dimethyl-1-pip…
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) | 3.22 | 7.97 | -36.73 | 2 | 2 | 1 | 20 | 233.379 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.22 | 8.6 | -86.4 | 3 | 2 | 2 | 21 | 234.387 | 3 | ↓ |