| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 16 | Yes |
Popular Name: (1R)-N-[(2-methyl-1H-imidazol-4-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine (1R)-N-[(2-methyl-1H-imidazol-4-…
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) | -0.60 | 4.21 | -38 | 3 | 6 | 1 | 73 | 221.288 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.60 | 3.79 | -17.23 | 2 | 6 | 0 | 71 | 220.28 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.60 | 5.02 | -50.92 | 3 | 6 | 1 | 76 | 221.288 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.60 | 5.5 | -107.28 | 4 | 6 | 2 | 77 | 222.296 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
