In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2005 | 23 | No |
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) | -0.05 | 2.89 | -15.26 | 2 | 7 | 0 | 101 | 330.369 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.05 | 5.22 | -44.63 | 2 | 7 | 0 | 105 | 330.369 | 3 | ↓ |