In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 8th, 2006 | 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) | 3.34 | 7.53 | -18.99 | 2 | 5 | 0 | 71 | 315.348 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.34 | 7.3 | -35.71 | 3 | 5 | 1 | 72 | 316.356 | 6 | ↓ |