In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2010 | 16 | Yes |
None
None
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) | 1.77 | 7.1 | -31.39 | 1 | 3 | 1 | 25 | 227.372 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.77 | 4.32 | -8.43 | 0 | 3 | 0 | 24 | 226.364 | 4 | ↓ |