In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2005 | 15 | 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) | 0.20 | 5.09 | -104.65 | 4 | 3 | 2 | 45 | 209.337 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.20 | 5.37 | -161.57 | 5 | 3 | 3 | 46 | 210.345 | 7 | ↓ |