In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 16 | Yes |
Popular Name: 3-[(3S)-3-methyl-1-piperidyl]-1-(2-thienyl)propan-1-one 3-[(3S)-3-methyl-1-piperidyl]-1-…
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) | 2.81 | 8.6 | -38.21 | 1 | 2 | 1 | 22 | 238.376 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.81 | 6.38 | -5.77 | 0 | 2 | 0 | 20 | 237.368 | 4 | ↓ |