In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 21 | No |
Popular Name: 2,2,2-trifluoro-N-[5-methyl-3-(piperazine-1-carbonyl)-2-thienyl]acetamide 2,2,2-trifluoro-N-[5-methyl-3-(p…
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) | 0.24 | 3.29 | -53.38 | 3 | 5 | 1 | 66 | 322.332 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.24 | 1.92 | -8.21 | 2 | 5 | 0 | 61 | 321.324 | 3 | ↓ |