In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 15 | Yes |
Popular Name: 3-[(2S)-2-ethyl-1-piperidyl]-N-propyl-propan-1-amine 3-[(2S)-2-ethyl-1-piperidyl]-N-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) | 2.70 | 8.03 | -100.26 | 3 | 2 | 2 | 21 | 214.397 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 5.88 | -36.95 | 2 | 2 | 1 | 20 | 213.389 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 6.67 | -30.08 | 2 | 2 | 1 | 16 | 213.389 | 7 | ↓ |