In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 19 | Yes |
Popular Name: (8S)-8-methyl-3-(3,4,5-trifluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine (8S)-8-methyl-3-(3,4,5-trifluoro…
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) | 2.01 | 6.31 | -59.66 | 2 | 4 | 1 | 47 | 269.25 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.01 | 5.01 | -9.49 | 1 | 4 | 0 | 43 | 268.242 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.