In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 4th, 2011 | 24 | Yes |
Popular Name: 2-methyl-N-[1-(1H-purin-6-yl)-4-piperidyl]thiazole-4-carboxamide 2-methyl-N-[1-(1H-purin-6-yl)-4-…
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) | 0.95 | 6.54 | -15.35 | 2 | 8 | 0 | 100 | 343.416 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.