In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 16 | 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) | 4.06 | 9.32 | -5.87 | 0 | 2 | 0 | 17 | 234.73 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.06 | 9.76 | -26.43 | 1 | 2 | 1 | 19 | 235.738 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.