In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 18 | Yes |
Popular Name: N,1-dimethyl-N-[[2-(methylaminomethyl)thiazol-4-yl]methyl]piperidin-4-amine N,1-dimethyl-N-[[2-(methylaminom…
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) | 0.62 | 4.11 | -81.49 | 3 | 4 | 2 | 37 | 270.446 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.62 | 2.66 | -36.31 | 2 | 4 | 1 | 33 | 269.438 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.62 | 6.64 | -166.33 | 4 | 4 | 3 | 38 | 271.454 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.