| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 26th, 2011 | 17 | Yes |
Popular Name: 2-[[(2R,6R)-2,6,7-triamino-7-oxo-heptanoyl]amino]acetic 2-[[(2R,6R)-2,6,7-triamino-7-oxo…
| 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) | -4.17 | -4.83 | -125.43 | 9 | 8 | 1 | 168 | 247.275 | 8 | ↓ |
| Hi High (pH 8-9.5) | -4.17 | -5.12 | -69.23 | 8 | 8 | 0 | 166 | 246.267 | 8 | ↓ |
| Hi High (pH 8-9.5) | -4.17 | -5.17 | -76.15 | 8 | 8 | 0 | 166 | 246.267 | 8 | ↓ |
| Hi High (pH 8-9.5) | -4.17 | -5.5 | -49.03 | 7 | 8 | -1 | 164 | 245.259 | 8 | ↓ |
