In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2008 | 33 | 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) | 1.93 | 5.94 | -64.08 | 2 | 9 | 1 | 106 | 496.993 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.93 | 3.5 | -25.61 | 1 | 9 | 0 | 105 | 495.985 | 8 | ↓ |