In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 28th, 2007 | 25 | 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 | -2.38 | -7.97 | 0 | 4 | 0 | 41 | 354.523 | 6 | ↓ |
Lo Low (pH 4.5-6) | 5.23 | -2.33 | -27.74 | 1 | 4 | 1 | 43 | 355.531 | 6 | ↓ |