In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 24th, 2011 | 18 | Yes |
Popular Name: 3,3,3-trifluoro-N-[[4-(2-thienyl)-2-thienyl]methyl]propan-1-amine 3,3,3-trifluoro-N-[[4-(2-thienyl…
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) | 4.10 | 8.23 | -47.88 | 2 | 1 | 1 | 17 | 292.371 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.10 | 6.87 | -4.73 | 1 | 1 | 0 | 12 | 291.363 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.