In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2010 | 29 | 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) | -0.91 | 5.55 | -105.47 | 4 | 9 | 2 | 103 | 401.515 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.91 | 5.07 | -60.43 | 3 | 9 | 1 | 102 | 400.507 | 4 | ↓ |