In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2009 | 17 | Yes |
Popular Name: (3S)-1-[(1S)-1-(2-thienyl)propyl]piperidine-3-carboxylic (3S)-1-[(1S)-1-(2-thienyl)propyl…
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) | 2.72 | 9.11 | -40.61 | 1 | 3 | 0 | 45 | 253.367 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.72 | 6.84 | -46.57 | 0 | 3 | -1 | 43 | 252.359 | 4 | ↓ |