In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2004 | 13 | 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) | 2.47 | 5.47 | -130.92 | 0 | 4 | -2 | 72 | 208.194 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.47 | 4.31 | -41.69 | 1 | 4 | -1 | 70 | 209.202 | 8 | ↓ |