| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 4th, 2008 | 30 | No |
Popular Name: 1,2-bis[(1-phenyltetrazol-5-yl)sulfanyl]ethane-1,2-dione 1,2-bis[(1-phenyltetrazol-5-yl)s…
| 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) | 1.92 | 6.17 | -119.09 | 0 | 12 | -2 | 158 | 438.458 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.92 | 5.23 | -127.69 | 0 | 12 | -2 | 158 | 438.458 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.92 | 4.2 | -58.04 | 1 | 12 | -1 | 155 | 439.466 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.92 | 4.66 | -55.08 | 1 | 12 | -1 | 155 | 439.466 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.92 | 3.18 | -21.89 | 2 | 12 | 0 | 152 | 440.474 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.92 | 5.14 | -49.74 | 1 | 12 | -1 | 155 | 439.466 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.92 | 4.12 | -19.23 | 2 | 12 | 0 | 152 | 440.474 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
