In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2011 | 19 | No |
Popular Name: 2-[(2S)-2-ethylsulfanyl-2,3-dihydrothiazol-4-yl]-N-[2-[(4R)-4H-imidazol-4-yl]ethyl]acetamide 2-[(2S)-2-ethylsulfanyl-2,3-dihy…
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) | 1.11 | 5.38 | -40.08 | 4 | 5 | 1 | 71 | 299.445 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.11 | 4.89 | -13.31 | 3 | 5 | 0 | 70 | 298.437 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.