In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 19 | 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) | 0.66 | 3.55 | -52.13 | 3 | 5 | 1 | 64 | 283.421 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.66 | 3.92 | -86.48 | 4 | 5 | 2 | 65 | 284.429 | 6 | ↓ |