In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 20th, 2009 | 26 | 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) | 3.78 | 6.81 | -64.09 | 2 | 4 | 0 | 43 | 358.502 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.78 | 6.14 | -6.97 | 1 | 4 | 0 | 42 | 357.494 | 2 | ↓ |