In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 22 | Yes |
Popular Name: 6-[[cyclopentyl(2-methoxyethyl)amino]methyl]-1-methyl-5H-pyrazolo[3,4-d]pyrimidin-4-one 6-[[cyclopentyl(2-methoxyethyl)a…
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) | 0.83 | 4.09 | -11.54 | 1 | 7 | 0 | 76 | 305.382 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.28 | 3.86 | -41.14 | 1 | 7 | 0 | 80 | 305.382 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.83 | 6.21 | -51.77 | 2 | 7 | 1 | 77 | 306.39 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.