In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2010 | 20 | 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) | 3.42 | 6.76 | -29.94 | 4 | 3 | 1 | 52 | 264.352 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.42 | 6.33 | -7.72 | 3 | 3 | 0 | 51 | 263.344 | 3 | ↓ |