In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 24 | Yes |
Popular Name: 1-[4-phenyl-1-[(5R)-5H-purin-6-yl]-4-piperidyl]ethanone 1-[4-phenyl-1-[(5R)-5H-purin-6-y…
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) | 1.30 | 9.76 | -15.03 | 1 | 6 | 0 | 75 | 321.384 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.