In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: (2S)-2-(2,4-dimethylphenyl)-2-[(3S,5S)-3,5-dimethyl-1-piperidyl]ethanamine (2S)-2-(2,4-dimethylphenyl)-2-[(…
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) | 3.18 | 6.98 | -47.35 | 3 | 2 | 1 | 31 | 261.433 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.18 | 8.73 | -27.25 | 3 | 2 | 1 | 30 | 261.433 | 3 | ↓ |