| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 18 | No |
Popular Name: 4-[(1S)-3-(dimethylamino)-1-methyl-propyl]-5-(2-thienyl)-1,2,4-triazole-3-thiol 4-[(1S)-3-(dimethylamino)-1-meth…
| 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) | 2.01 | 9.09 | -38.28 | 2 | 4 | 1 | 38 | 283.446 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.74 | 9 | -54.99 | 1 | 4 | 0 | 35 | 282.438 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
