In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 11 | 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) | -2.33 | 2.6 | -38.73 | 3 | 4 | 0 | 71 | 160.217 | 4 | ↓ |
Mid Mid (pH 6-8) | -2.33 | 1.03 | -32.74 | 3 | 4 | 0 | 71 | 160.217 | 4 | ↓ |
Mid Mid (pH 6-8) | -2.33 | 2.97 | -78.34 | 4 | 4 | 1 | 72 | 161.225 | 4 | ↓ |