In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 17 | 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) | 2.42 | 8.62 | -24.32 | 3 | 3 | 1 | 45 | 224.287 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.42 | 8.21 | -11.47 | 2 | 3 | 0 | 43 | 223.279 | 1 | ↓ |