| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 19th, 2009 | 17 | Yes |
Popular Name: (1R)-1-(3-methoxyphenyl)-N-(4H-1,2,4-triazol-3-ylmethyl)ethanamine (1R)-1-(3-methoxyphenyl)-N-(4H-1…
None
| 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) | 1.05 | 5.09 | -33.33 | 2 | 5 | 0 | 66 | 232.287 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.05 | 4.14 | -9.64 | 2 | 5 | 0 | 63 | 232.287 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.05 | 5.23 | -47.44 | 3 | 5 | 1 | 67 | 233.295 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
