| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 18 | Yes |
Popular Name: (4R)-N-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]-4,5,6,7-tetrahydrobenzothiophen-4-amine (4R)-N-[(4,5-dimethyl-1,2,4-tria…
| 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) | 0.30 | 7.84 | -48.7 | 2 | 4 | 1 | 47 | 263.39 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.30 | 6.69 | -11.69 | 1 | 4 | 0 | 43 | 262.382 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
