In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 5th, 2011 | 19 | No |
Popular Name: 5-bromo-N-[2-(4-ethyl-5-sulfanyl-1,2,4-triazol-3-yl)ethyl]thiophene-2-carboxamide 5-bromo-N-[2-(4-ethyl-5-sulfanyl…
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) | 1.76 | 6.8 | -19.52 | 2 | 5 | 0 | 63 | 361.29 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.48 | 6.58 | -50.13 | 1 | 5 | -1 | 60 | 360.282 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.