In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 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) | 3.63 | 9.38 | -55.03 | 0 | 4 | -1 | 62 | 290.726 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.63 | 9.84 | -69 | 1 | 4 | 0 | 63 | 291.734 | 6 | ↓ |