In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2008 | 20 | Yes |
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) | 2.43 | 7.08 | -56.44 | 0 | 5 | -1 | 71 | 272.28 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.43 | 7.52 | -64.91 | 1 | 5 | 0 | 73 | 273.288 | 6 | ↓ |