In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 34 | 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) | 3.95 | 11.77 | -47.34 | 2 | 6 | 1 | 71 | 470.471 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.95 | 9.29 | -14.92 | 1 | 6 | 0 | 70 | 469.463 | 3 | ↓ |