In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 14 | 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) | -0.26 | 5.2 | -34.72 | 3 | 3 | 0 | 68 | 193.246 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.26 | 4.95 | -46.87 | 2 | 3 | -1 | 66 | 192.238 | 3 | ↓ |