In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2008 | 25 | Yes |
Popular Name: 1-(5-chloro-2-methyl-phenyl)-N-(3-pyridylmethyl)pyrazolo[4,5-e]pyrimidin-4-amine 1-(5-chloro-2-methyl-phenyl)-N-(…
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 | 10.18 | -12.58 | 1 | 6 | 0 | 69 | 350.813 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.98 | 10.62 | -48.85 | 2 | 6 | 1 | 70 | 351.821 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.