In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 15 | 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) | 2.23 | 4.71 | -97.06 | 5 | 3 | 2 | 56 | 213.369 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.68 | 4.72 | -23.17 | 5 | 3 | 1 | 56 | 212.361 | 3 | ↓ |