In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2008 | 19 | 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) | 2.05 | 5.5 | -34.14 | 1 | 4 | 1 | 26 | 265.377 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.05 | 5.5 | -33.94 | 1 | 4 | 1 | 26 | 265.377 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.05 | 3.19 | -4.99 | 0 | 4 | 0 | 25 | 264.369 | 5 | ↓ |