In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 16th, 2005 | 16 | 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) | 4.11 | 7.58 | -8.76 | 1 | 3 | 0 | 41 | 231.324 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.19 | 7.72 | -24.6 | 2 | 3 | 1 | 39 | 232.332 | 3 | ↓ |