In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 20 | Yes |
Popular Name: N-[(1S)-1-(5-ethyl-2-thienyl)ethyl]-3-[(2S)-2-methyl-1-piperidyl]propan-1-amine N-[(1S)-1-(5-ethyl-2-thienyl)eth…
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) | 4.29 | 9.72 | -31.65 | 2 | 2 | 1 | 16 | 295.516 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.29 | 10.94 | -102.49 | 3 | 2 | 2 | 21 | 296.524 | 7 | ↓ |