In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 10th, 2006 | 16 | 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) | 2.56 | 8.4 | -41.59 | 1 | 2 | 1 | 22 | 222.283 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.56 | 6.23 | -6.57 | 0 | 2 | 0 | 20 | 221.275 | 3 | ↓ |