In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 22 | Yes |
Popular Name: (5R)-9-methyl-2-(3-piperazin-1-ylpropanoyl)-2,9-diazaspiro[4.5]decan-10-one (5R)-9-methyl-2-(3-piperazin-1-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) | -0.78 | 3.01 | -48.76 | 2 | 6 | 1 | 60 | 309.434 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.78 | 1.66 | -12.91 | 1 | 6 | 0 | 56 | 308.426 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.