In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 20 | 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) | 0.25 | 3.29 | -59.34 | 4 | 4 | 1 | 74 | 291.396 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.25 | 2.98 | -10.41 | 3 | 4 | 0 | 72 | 290.388 | 5 | ↓ |