In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 14 | 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) | -0.07 | 2.65 | -40.31 | 4 | 4 | 1 | 59 | 193.274 | 1 | ↓ |
Hi High (pH 8-9.5) | -0.07 | 1.35 | -5.38 | 3 | 4 | 0 | 54 | 192.266 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.07 | 3.07 | -86.18 | 5 | 4 | 2 | 60 | 194.282 | 1 | ↓ |