In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 27 | Yes |
Popular Name: 3-[2-(3,4-dimethoxyphenyl)acetyl]-12-methyl-3,8,12-triazaspiro[5.6]dodecan-7-one 3-[2-(3,4-dimethoxyphenyl)acetyl…
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) | 0.84 | 5.45 | -52.79 | 2 | 7 | 1 | 72 | 376.477 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.84 | 3.76 | -15.83 | 1 | 7 | 0 | 71 | 375.469 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.