In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2008 | 27 | No |
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) | 1.56 | 4.98 | -20.76 | 1 | 8 | 0 | 94 | 367.34 | 4 | ↓ |
Ref Reference (pH 7) | 1.56 | 4.35 | -15.4 | 1 | 8 | 0 | 94 | 367.34 | 4 | ↓ |
Ref Reference (pH 7) | 1.56 | 3.83 | -13.7 | 1 | 8 | 0 | 94 | 367.34 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.56 | 2.98 | -55.37 | 2 | 8 | 1 | 96 | 368.348 | 4 | ↓ |