In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 17 | Yes |
Popular Name: 1-[3,5-dimethyl-1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]pyrazol-4-yl]-N-methyl-methanamine 1-[3,5-dimethyl-1-[(5-methyl-1,3…
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) | -1.05 | -0.05 | -49.39 | 2 | 6 | 1 | 73 | 236.299 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.05 | -1.51 | -12.68 | 1 | 6 | 0 | 69 | 235.291 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.