In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2008 | 29 | No |
Popular Name: N-[3-(3-methyl-[1,2,4]triazolo[3,4-f]pyridazin-6-yl)phenyl]-3-nitro-benzenesulfonamide N-[3-(3-methyl-[1,2,4]triazolo[3…
None
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) | 2.69 | -1.97 | -21.53 | 1 | 10 | 0 | 135 | 410.415 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.69 | -1.39 | -45.44 | 0 | 10 | -1 | 137 | 409.407 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.