In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 33 | 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) | 0.78 | 5.74 | -26.04 | 3 | 11 | 0 | 144 | 489.583 | 10 | ↓ |
Hi High (pH 8-9.5) | 0.97 | 4.53 | -57.04 | 2 | 11 | -1 | 150 | 488.575 | 10 | ↓ |