In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 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) | 1.14 | 1.74 | -60.3 | 3 | 5 | 1 | 74 | 297.4 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.14 | 1.34 | -8.84 | 2 | 5 | 0 | 73 | 296.392 | 3 | ↓ |