| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 11th, 2011 | 23 | No |
Popular Name: 2-[(3S)-5-[(E)-1-methyl-2-(4-methylsulfanylphenyl)vinyl]-3H-1,2,4-triazol-3-yl]phenol 2-[(3S)-5-[(E)-1-methyl-2-(4-met…
| 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) | 4.81 | 6.41 | -37.19 | 2 | 4 | 1 | 59 | 324.429 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.81 | 7.29 | -115.09 | 3 | 4 | 2 | 61 | 325.437 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
