In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2011 | 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) | 0.38 | 2.23 | -58.69 | 4 | 3 | 1 | 61 | 189.238 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.38 | 1.84 | -8.71 | 3 | 3 | 0 | 59 | 188.23 | 2 | ↓ |