In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 9th, 2011 | 18 | Yes |
Popular Name: N-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]-N-methyl-1H-1,2,4-triazole-5-carboxamide N-[(3-isopropyl-1,2,4-oxadiazol-…
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) | -0.53 | 2.42 | -41.83 | 0 | 8 | -1 | 99 | 249.254 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.53 | 2.62 | -18.47 | 1 | 8 | 0 | 101 | 250.262 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.