In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 29th, 2011 | 18 | 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) | 2.80 | 6.4 | -8.68 | 0 | 3 | 0 | 24 | 266.41 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.80 | 8.61 | -45.33 | 1 | 3 | 1 | 25 | 267.418 | 5 | ↓ |