In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 13 | Yes |
Popular Name: (2S,4S)-2-methyl-4-thiazol-2-yl-tetrahydropyran-4-amine (2S,4S)-2-methyl-4-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) | 0.79 | 1.38 | -41.69 | 3 | 3 | 1 | 50 | 199.299 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.79 | 1.36 | -5.3 | 2 | 3 | 0 | 48 | 198.291 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.