In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 28th, 2010 | 32 | 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) | 4.22 | 15.29 | -40.14 | 1 | 6 | 1 | 55 | 473.066 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.22 | 12.83 | -11.45 | 0 | 6 | 0 | 54 | 472.058 | 9 | ↓ |