In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2011 | 21 | Yes |
Popular Name: 7-[(1S,2S,4R)-2,4-dimethylcyclohexyl]-2,5,6-trimethyl-pyrrolo[2,3-d]pyrimidin-4-amine 7-[(1S,2S,4R)-2,4-dimethylcycloh…
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) | 3.06 | 9.76 | -8.24 | 2 | 4 | 0 | 57 | 286.423 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.06 | 10.14 | -22.22 | 3 | 4 | 1 | 58 | 287.431 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.