In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 18 | Yes |
Popular Name: N,4-dimethyl-5-[(1S)-1-(methylamino)ethyl]-N-tetrahydropyran-4-yl-thiazol-2-amine N,4-dimethyl-5-[(1S)-1-(methylam…
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) | 2.05 | 5.41 | -39.19 | 2 | 4 | 1 | 42 | 270.422 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.05 | 4.1 | -5.19 | 1 | 4 | 0 | 37 | 269.414 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.