In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 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) | 3.16 | 6.98 | -39.06 | 1 | 2 | 1 | 28 | 195.33 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.16 | 5.03 | -5.17 | 0 | 2 | 0 | 27 | 194.322 | 3 | ↓ |