In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2011 | 21 | Yes |
Popular Name: 5-chloro-N-(3-fluoro-4-hydroxy-phenyl)-2-isopropyl-pyrimidine-4-carboxamide 5-chloro-N-(3-fluoro-4-hydroxy-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) | 2.98 | 3.49 | -9.56 | 2 | 5 | 0 | 75 | 309.728 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.98 | 4.25 | -48.68 | 1 | 5 | -1 | 78 | 308.72 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.