In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 33 | 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) | 3.23 | 6.29 | -14.56 | 2 | 8 | 0 | 83 | 456.518 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.23 | 8.16 | -57.65 | 3 | 8 | 1 | 84 | 457.526 | 6 | ↓ |