In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 19 | Yes |
Popular Name: N-(2-ethyl-1,3-benzoxazol-5-yl)-1H-triazole-4-carboxamide N-(2-ethyl-1,3-benzoxazol-5-yl)-…
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) | 1.48 | -0.05 | -9.7 | 2 | 7 | 0 | 97 | 257.253 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.48 | -0.16 | -36.68 | 1 | 7 | -1 | 95 | 256.245 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.