In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | 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) | -0.50 | -0.19 | -38.54 | 5 | 7 | 1 | 110 | 300.379 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.50 | -1.01 | -13.45 | 4 | 7 | 0 | 108 | 299.371 | 7 | ↓ |