In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 11 | 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) | 1.18 | 4.18 | -41.51 | 2 | 2 | 1 | 29 | 151.233 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.18 | 4.65 | -86.14 | 3 | 2 | 2 | 31 | 152.241 | 4 | ↓ |