In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 17 | 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) | 3.29 | 7.19 | -7.05 | 0 | 2 | 0 | 22 | 223.275 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.29 | 7.62 | -35.53 | 1 | 2 | 1 | 23 | 224.283 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.29 | 7.62 | -35.54 | 1 | 2 | 1 | 23 | 224.283 | 2 | ↓ |