In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 32 | 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) | 0.91 | 3.31 | -61.43 | 0 | 9 | -1 | 104 | 436.444 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.91 | 5.65 | -73.08 | 1 | 9 | 0 | 105 | 437.452 | 6 | ↓ |