In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 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) | 3.23 | 6.18 | -2.97 | 1 | 2 | 0 | 23 | 233.355 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.23 | 6.54 | -31.65 | 2 | 2 | 1 | 25 | 234.363 | 3 | ↓ |