In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 31st, 2006 | 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) | -1.17 | -3.17 | -12.23 | 4 | 8 | 0 | 119 | 237.219 | 1 | ↓ |
Lo Low (pH 4.5-6) | -1.17 | -2.91 | -32.7 | 5 | 8 | 1 | 121 | 238.227 | 1 | ↓ |
Lo Low (pH 4.5-6) | -1.17 | -7.29 | -33.29 | 5 | 8 | 1 | 121 | 238.227 | 1 | ↓ |