| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 21 | No |
Popular Name: 3-ethyl-4-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methyleneamino]-1H-1,2,4-triazole-5-thione 3-ethyl-4-[(Z)-(7-methoxy-1,3-be…
| 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) | 1.22 | 5.01 | -17.34 | 1 | 7 | 0 | 74 | 306.347 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.95 | 4.93 | -61.45 | 0 | 7 | -1 | 71 | 305.339 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
