In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 14 | Yes |
Popular Name: (2S,4R)-2-methyl-N-(thiazol-2-ylmethyl)tetrahydropyran-4-amine (2S,4R)-2-methyl-N-(thiazol-2-yl…
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) | 0.90 | 2.92 | -39.83 | 2 | 3 | 1 | 39 | 213.326 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.90 | 1.74 | -5.34 | 1 | 3 | 0 | 34 | 212.318 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.