In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2009 | 28 | 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) | -1.09 | 2.3 | -88.1 | 6 | 7 | 1 | 122 | 387.456 | 3 | ↓ |
Hi High (pH 8-9.5) | -1.09 | 1.98 | -72.13 | 5 | 7 | 0 | 120 | 386.448 | 3 | ↓ |