| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 18 | Yes |
Popular Name: (3S)-1-[(2R)-2-aminobutanoyl]-3-[(sulfamoylamino)methyl]piperidine (3S)-1-[(2R)-2-aminobutanoyl]-3-…
| 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) | -1.28 | -3.45 | -51.74 | 6 | 7 | 1 | 120 | 279.386 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.28 | -3.76 | -16.41 | 5 | 7 | 0 | 119 | 278.378 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.28 | -4.1 | -44.12 | 4 | 7 | -1 | 121 | 277.37 | 5 | ↓ |
