In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 15 | No |
Popular Name: 3-phenyl-1,5,6,7-tetrahydro-[1,2,4]triazolo[4,3-a]pyrimidine 3-phenyl-1,5,6,7-tetrahydro-[1,2…
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) | 2.06 | 7.8 | -28.09 | 2 | 4 | 1 | 48 | 201.253 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.89 | 7.67 | -13.4 | 1 | 4 | 0 | 43 | 200.245 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.