| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2008 | 31 | Yes |
Popular Name: N-[5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]-methyl-BLAHcarboxamide N-[5-(4-methoxyphenyl)-4H-1,2,4-…
| 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) | 3.00 | 10.85 | -23 | 2 | 9 | 0 | 111 | 417.473 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 11.77 | -35.81 | 3 | 9 | 1 | 112 | 418.481 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 10.73 | -63.51 | 1 | 9 | -1 | 109 | 416.465 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
