In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2004 | 22 | Yes |
Popular Name: (2R)-2-[(2R)-2-methylpiperidin-1-ium-1-yl]-N-(4-sulfamoylphenyl)propionamide (2R)-2-[(2R)-2-methylpiperidin-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) | 1.41 | 2.51 | -44.29 | 4 | 6 | 1 | 94 | 326.442 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.59 | 0.79 | -29.21 | 3 | 6 | 0 | 100 | 325.434 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.59 | -1.24 | -43.71 | 2 | 6 | -1 | 99 | 324.426 | 4 | ↓ |