| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2006 | 27 | No |
Popular Name: 3-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-(p-tolylmethyl)propanamide 3-[3-(4-methoxyphenyl)-5-thioxo-…
| 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) | 2.84 | 9.53 | -12.74 | 2 | 6 | 0 | 72 | 382.489 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 9.64 | -48.01 | 1 | 6 | -1 | 69 | 381.481 | 7 | ↓ |
