In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 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) | 1.08 | 4.73 | -56.66 | 0 | 4 | -1 | 66 | 219.245 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.08 | 5.19 | -72.14 | 1 | 4 | 0 | 67 | 220.253 | 3 | ↓ |