In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2008 | 32 | 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 | 12.99 | -45.55 | 2 | 4 | 1 | 37 | 424.568 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 10.61 | -8.22 | 1 | 4 | 0 | 36 | 423.56 | 2 | ↓ |