In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2009 | 34 | 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) | 4.17 | 11.84 | -21.06 | 1 | 5 | 0 | 52 | 478.568 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.17 | 13.42 | -68.79 | 2 | 5 | 1 | 53 | 479.576 | 5 | ↓ |