In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2005 | 15 | 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) | -2.37 | 5.38 | -111.1 | 0 | 6 | -2 | 101 | 213.189 | 4 | ↓ |
Lo Low (pH 4.5-6) | -2.37 | 3.4 | -57.58 | 1 | 6 | -1 | 98 | 214.197 | 4 | ↓ |