In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | 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) | 1.92 | 7.18 | -45.39 | 2 | 4 | 1 | 42 | 264.393 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.92 | 6.13 | -9.34 | 1 | 4 | 0 | 37 | 263.385 | 4 | ↓ |