In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2010 | 25 | No |
None
None
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) | 0.28 | 6.42 | -46.07 | 2 | 7 | 1 | 74 | 353.487 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.28 | 4.33 | -24.52 | 1 | 7 | 0 | 73 | 352.479 | 7 | ↓ |