In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 21 | Yes |
Popular Name: 1-[4-[[(1R)-1-[(3S)-1-propyl-3-piperidyl]ethyl]amino]-1-piperidyl]ethanone 1-[4-[[(1R)-1-[(3S)-1-propyl-3-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) | 1.89 | 8.2 | -113.23 | 3 | 4 | 2 | 41 | 297.487 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.89 | 7.34 | -39.46 | 2 | 4 | 1 | 37 | 296.479 | 5 | ↓ |