In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 3rd, 2009 | 15 | Yes |
None
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) | 4.79 | 8.09 | -6.43 | 0 | 1 | 0 | 13 | 199.297 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.79 | 8.36 | -23.26 | 1 | 1 | 1 | 14 | 200.305 | 1 | ↓ |