| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 11th, 2011 | 26 | No |
Popular Name: phenyl-(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)BLAHone phenyl-(5-thioxo-1,2-dihydro-1,2…
| 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) | 1.86 | 12.7 | -39.88 | 1 | 9 | -1 | 107 | 361.37 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.14 | 13.01 | -21.26 | 2 | 9 | 0 | 110 | 362.378 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
