In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 19 | 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) | 1.97 | 6.14 | -39.13 | 1 | 5 | 1 | 37 | 272.413 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.97 | 4.05 | -5.51 | 0 | 5 | 0 | 36 | 271.405 | 8 | ↓ |