In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | 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) | 1.04 | 8.95 | -61.04 | 1 | 6 | -1 | 87 | 286.311 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.04 | 9.46 | -79.35 | 2 | 6 | 0 | 88 | 287.319 | 7 | ↓ |