In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 17 | No |
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) | -1.88 | 4.37 | -51.87 | 3 | 4 | 1 | 65 | 233.291 | 2 | ↓ |
Hi High (pH 8-9.5) | -1.88 | 4.04 | -13.36 | 2 | 4 | 0 | 63 | 232.283 | 2 | ↓ |