In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2008 | 23 | No |
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) | 6.89 | 12.61 | -5.75 | 0 | 2 | 0 | 22 | 309.453 | 9 | ↓ |
Lo Low (pH 4.5-6) | 6.89 | 12.23 | -34.26 | 1 | 2 | 1 | 23 | 310.461 | 9 | ↓ |
Lo Low (pH 4.5-6) | 6.89 | 12.96 | -32.11 | 1 | 2 | 1 | 23 | 310.461 | 9 | ↓ |