In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 22 | Yes |
None
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) | 4.15 | 10.89 | -33.63 | 1 | 2 | 1 | 8 | 295.45 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.15 | 8.95 | -2.5 | 0 | 2 | 0 | 6 | 294.442 | 4 | ↓ |