In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 27 | Yes |
Popular Name: N-cyclododecyl-5-oxo-1-phenyl-4H-1,2,4-triazole-3-carboxamide N-cyclododecyl-5-oxo-1-phenyl-4H…
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) | 4.61 | 11.39 | -7.92 | 2 | 6 | 0 | 80 | 370.497 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.07 | 9.54 | -50.29 | 1 | 6 | -1 | 83 | 369.489 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.