In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 20 | Yes |
Popular Name: 4-(3-Trifluoromethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-benzylamine 4-(3-Trifluoromethyl-[1,2,4]tria…
1-{4-[3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]phenyl}methanamine
None
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) | 2.27 | 5.2 | -60.24 | 3 | 5 | 1 | 71 | 300.289 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.27 | 4.8 | -7.68 | 2 | 5 | 0 | 69 | 299.281 | 3 | ↓ |