In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 20 | 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) | 2.48 | 6.81 | -38.07 | 1 | 4 | 1 | 44 | 265.34 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.48 | 6.52 | -8.49 | 0 | 4 | 0 | 43 | 264.332 | 2 | ↓ |