In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | 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) | 1.40 | 1.05 | -37.84 | 5 | 5 | 1 | 91 | 268.381 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.40 | 0.71 | -9.59 | 4 | 5 | 0 | 89 | 267.373 | 3 | ↓ |