In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 29 | No |
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) | 4.23 | 9.22 | -58.17 | 0 | 5 | -1 | 70 | 396.438 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.23 | 8.46 | -15.51 | 1 | 5 | 0 | 67 | 397.446 | 5 | ↓ |