In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 17 | Yes |
Popular Name: (3S,4R)-3-[(3S)-3-ethyl-1-piperidyl]-N-methyl-heptan-4-amine (3S,4R)-3-[(3S)-3-ethyl-1-piperi…
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) | 4.07 | 8.72 | -109.88 | 3 | 2 | 2 | 21 | 242.451 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.07 | 7.42 | -30.24 | 2 | 2 | 1 | 16 | 241.443 | 7 | ↓ |