In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2008 | 17 | 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) | 2.06 | 6.11 | -86.39 | 3 | 3 | 2 | 24 | 241.423 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.06 | 3.9 | -37.87 | 2 | 3 | 1 | 23 | 240.415 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.06 | 2.72 | -1.24 | 1 | 3 | 0 | 19 | 239.407 | 5 | ↓ |