In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2011 | 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) | 2.45 | 7.06 | -17.15 | 2 | 5 | 0 | 67 | 310.332 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.45 | 7.53 | -40.85 | 3 | 5 | 1 | 68 | 311.34 | 5 | ↓ |