In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2010 | 35 | 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) | 1.06 | 8.04 | -100.32 | 4 | 8 | 2 | 83 | 485.673 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.06 | 5.69 | -53.02 | 3 | 8 | 1 | 82 | 484.665 | 5 | ↓ |