In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 16 | 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) | 4.02 | 7.12 | -5.16 | 1 | 2 | 0 | 25 | 222.307 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.02 | 7.59 | -27.12 | 2 | 2 | 1 | 26 | 223.315 | 3 | ↓ |