In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 5th, 2007 | 26 | 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) | 5.09 | 10.39 | -13.54 | 1 | 4 | 0 | 63 | 378.478 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.55 | 9.28 | -48.6 | 0 | 4 | -1 | 66 | 377.47 | 5 | ↓ |