In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 20 | Yes |
Popular Name: (3R,6R)-1-[[4-(3-hydroxyprop-1-ynyl)-2-thienyl]methyl]-6-methyl-piperidine-3-carboxamide (3R,6R)-1-[[4-(3-hydroxyprop-1-y…
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) | 0.97 | 3.34 | -43.41 | 4 | 4 | 1 | 68 | 293.412 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.97 | 1.22 | -13.84 | 3 | 4 | 0 | 67 | 292.404 | 3 | ↓ |