In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 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) | 4.97 | 10.82 | -39.1 | 2 | 1 | 1 | 17 | 254.397 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.97 | 9.68 | -2.14 | 1 | 1 | 0 | 12 | 253.389 | 5 | ↓ |