In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | 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) | 2.31 | 4.34 | -44.51 | 3 | 3 | 1 | 40 | 267.437 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.31 | 5.69 | -116.39 | 4 | 3 | 2 | 41 | 268.445 | 3 | ↓ |