In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2008 | 24 | Yes |
Popular Name: 2-[(3S,5R)-3,5-dimethyl-1-piperidyl]-N-[4-(4-fluorophenyl)thiazol-2-yl]acetamide 2-[(3S,5R)-3,5-dimethyl-1-piperi…
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) | 4.03 | 10.15 | -46.27 | 2 | 4 | 1 | 46 | 348.467 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.03 | 7.97 | -9.57 | 1 | 4 | 0 | 45 | 347.459 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.85 | 9.1 | -30.98 | 1 | 4 | 0 | 53 | 347.459 | 4 | ↓ |