In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 37 | 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) | 5.65 | 16.03 | -42.89 | 1 | 5 | 1 | 51 | 501.691 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.65 | 13.84 | -9.28 | 0 | 5 | 0 | 50 | 500.683 | 3 | ↓ |