| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2008 | 23 | No |
Popular Name: 3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-(1,3,4-thiadiazol-2-yl)propanamide 3-[3-(m-tolyl)-5-thioxo-1H-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) | 2.50 | 7.47 | -56.15 | 1 | 7 | -1 | 86 | 345.433 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.69 | 6.4 | -102.64 | 0 | 7 | -2 | 92 | 344.425 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.78 | 7.63 | -23.3 | 2 | 7 | 0 | 88 | 346.441 | 5 | ↓ |
