In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2010 | 23 | Yes |
Popular Name: (2R)-2-[(3S,5R)-3,5-dimethyl-1-piperidyl]-2-(3,4,5-trimethoxyphenyl)ethanamine (2R)-2-[(3S,5R)-3,5-dimethyl-1-p…
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) | 1.99 | 4.66 | -52.12 | 3 | 5 | 1 | 59 | 323.457 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.99 | 6.18 | -42.18 | 3 | 5 | 1 | 58 | 323.457 | 6 | ↓ |