In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 23 | 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) | 5.23 | 9.87 | -54.6 | 1 | 4 | -1 | 61 | 312.389 | 7 | ↓ |
Lo Low (pH 4.5-6) | 5.23 | 7.88 | -8.88 | 2 | 4 | 0 | 59 | 313.397 | 7 | ↓ |