In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 19 | Yes |
Popular Name: 5-[(1R)-1-aminoethyl]-N-(1-ethyl-4-piperidyl)-N,4-dimethyl-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) | 0.22 | 6.56 | -85.74 | 4 | 4 | 2 | 48 | 284.473 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.22 | 6.23 | -38.5 | 3 | 4 | 1 | 47 | 283.465 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.