In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 5th, 2007 | 30 | 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) | 3.88 | 9.41 | -38.97 | 0 | 6 | -1 | 79 | 473.343 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.29 | -0.64 | -20.03 | 0 | 6 | 0 | 72 | 474.351 | 8 | ↓ |