In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 2nd, 2011 | 14 | No |
Popular Name: 3-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]propanal 3-[(4-cyclopropyl-5-oxo-1H-1,2,4…
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) | 0.48 | 4.06 | -12.5 | 1 | 5 | 0 | 68 | 213.262 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.