In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2010 | 15 | 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) | -0.29 | 5.71 | -68.03 | 1 | 5 | 0 | 65 | 214.265 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.29 | 3.31 | -49.05 | 0 | 5 | -1 | 64 | 213.257 | 3 | ↓ |