In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 15 | Yes |
None
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) | -0.59 | 4.98 | -45.74 | 3 | 4 | 0 | 71 | 214.309 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.59 | 3.24 | -32.2 | 3 | 4 | 0 | 71 | 214.309 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.59 | 5.26 | -83.24 | 4 | 4 | 1 | 72 | 215.317 | 4 | ↓ |