In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 15 | Yes |
Popular Name: 4-chloro-6-isopropyl-2-(4H-1,2,4-triazol-3-yl)pyrimidine 4-chloro-6-isopropyl-2-(4H-1,2,4…
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) | 2.20 | 4.86 | -12.91 | 1 | 5 | 0 | 67 | 223.667 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.20 | 4.68 | -44.42 | 0 | 5 | -1 | 66 | 222.659 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.