In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 16 | Yes |
Popular Name: (2R,4S)-2-ethyl-2-methyl-N-(thiazol-2-ylmethyl)tetrahydropyran-4-amine (2R,4S)-2-ethyl-2-methyl-N-(thia…
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) | 1.84 | 4.22 | -41.32 | 2 | 3 | 1 | 39 | 241.38 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.84 | 3.02 | -5.81 | 1 | 3 | 0 | 34 | 240.372 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.