In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2009 | 31 | 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) | -1.94 | -0.84 | -71.94 | 3 | 9 | -1 | 129 | 434.444 | 7 | ↓ |
Mid Mid (pH 6-8) | -1.94 | 1.37 | -100.78 | 4 | 9 | 0 | 130 | 435.452 | 7 | ↓ |
Mid Mid (pH 6-8) | -4.52 | -1.8 | -33.01 | 4 | 9 | 0 | 132 | 435.452 | 6 | ↓ |