In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 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) | 2.88 | 6.13 | -58.64 | 4 | 3 | 1 | 57 | 255.341 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.88 | 5.74 | -10.01 | 3 | 3 | 0 | 55 | 254.333 | 4 | ↓ |