| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 17 | Yes |
Popular Name: (2R)-N-methyl-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethanamine (2R)-N-methyl-2-[(5-methyl-4H-1,…
| 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) | 1.76 | 6.4 | -38.84 | 3 | 4 | 1 | 58 | 249.363 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.76 | 4.9 | -5.9 | 2 | 4 | 0 | 54 | 248.355 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
