In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 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) | 2.56 | 7.94 | -47.48 | 2 | 4 | 1 | 57 | 256.329 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.56 | 5.86 | -13.13 | 1 | 4 | 0 | 56 | 255.321 | 7 | ↓ |