In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 18 | Yes |
Popular Name: 3-[5-[(4-ethyl-1-piperidyl)methyl]-3-thienyl]prop-2-yn-1-ol 3-[5-[(4-ethyl-1-piperidyl)methy…
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) | 2.97 | 7.53 | -40.06 | 2 | 2 | 1 | 25 | 264.414 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.97 | 5.27 | -6.57 | 1 | 2 | 0 | 23 | 263.406 | 3 | ↓ |