In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 18 | 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) | 1.43 | 1.79 | -5.9 | 1 | 4 | 0 | 42 | 251.326 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 4.18 | -43.73 | 2 | 4 | 1 | 43 | 252.334 | 5 | ↓ |