In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2008 | 15 | 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) | -1.22 | -1.11 | -15.5 | 2 | 6 | 0 | 79 | 211.221 | 0 | ↓ |
Hi High (pH 8-9.5) | -1.03 | -2.91 | -45.6 | 1 | 6 | -1 | 85 | 210.213 | 0 | ↓ |