In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2009 | 39 | 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) | 5.16 | 12.51 | -48.03 | 2 | 6 | 1 | 69 | 534.717 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.16 | 10.68 | -12.79 | 1 | 6 | 0 | 68 | 533.709 | 4 | ↓ |