In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2009 | 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) | 3.22 | 6.94 | -14.32 | 0 | 8 | 0 | 81 | 472.545 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 9.14 | -65.46 | 1 | 8 | 1 | 82 | 473.553 | 6 | ↓ |