In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2009 | 17 | 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) | 2.13 | 7.63 | -49.4 | 3 | 1 | 1 | 28 | 295.175 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.13 | 7.31 | -5.27 | 2 | 1 | 0 | 26 | 294.167 | 3 | ↓ |