| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2010 | 11 | Yes |
Popular Name: 3-methyl-5-(2-pyrrolidinyl)-1H-1,2,4-triazole 3-methyl-5-(2-pyrrolidinyl)-1H-1…
Find On: PubMed — Wikipedia — Google
CAS Number: 1609403-06-6
| 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) | -0.27 | 2.28 | -33.88 | 3 | 4 | 1 | 58 | 153.209 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.27 | 0.94 | -6.9 | 2 | 4 | 0 | 54 | 152.201 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
