| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 23 | No |
Popular Name: (Z)-N'-(4-acetylphenyl)-2-methyl-N-(1H-tetrazol-5-yl)but-2-enediamide (Z)-N'-(4-acetylphenyl)-2-methyl…
| 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) | 0.70 | 3.9 | -62.64 | 2 | 9 | -1 | 136 | 313.297 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.70 | 3.94 | -141.56 | 1 | 9 | -2 | 134 | 312.289 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.52 | 5.44 | -68.18 | 2 | 9 | -1 | 128 | 313.297 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.52 | 5.45 | -22.94 | 3 | 9 | 0 | 130 | 314.305 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
