| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 15 | Yes |
Popular Name: (1S)-1-(4-methyl-1,2,4-triazol-3-yl)-N-(thiazol-5-ylmethyl)ethanamine (1S)-1-(4-methyl-1,2,4-triazol-3…
| 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) | 0.25 | 4.93 | -49.23 | 2 | 5 | 1 | 60 | 224.313 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.25 | 3.66 | -14.57 | 1 | 5 | 0 | 56 | 223.305 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
