In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 15 | 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) | 0.83 | 4.21 | -85.98 | 3 | 3 | 2 | 24 | 213.369 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.83 | 6.57 | -193.14 | 4 | 3 | 3 | 25 | 214.377 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.83 | 5.17 | -95.79 | 3 | 3 | 2 | 21 | 213.369 | 3 | ↓ |