In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 18 | Yes |
Popular Name: 5-[(1R)-1-aminoethyl]-N-(1-ethyl-4-piperidyl)-N-methyl-thiazol-2-amine 5-[(1R)-1-aminoethyl]-N-(1-ethyl…
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) | -0.01 | 6.06 | -86.77 | 4 | 4 | 2 | 48 | 270.446 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.01 | 5.73 | -38.36 | 3 | 4 | 1 | 47 | 269.438 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.