In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 20 | Yes |
Popular Name: (3S,4S)-3-[(3S)-3-ethyl-1-piperidyl]-N-methyl-chroman-4-amine (3S,4S)-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) | 3.22 | 7.36 | -35.96 | 2 | 3 | 1 | 26 | 275.416 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 8.44 | -119.75 | 3 | 3 | 2 | 30 | 276.424 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 6.6 | -36.6 | 2 | 3 | 1 | 29 | 275.416 | 3 | ↓ |