In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 20 | No |
Popular Name: (2S,3S)-3-chloro-N-[2-(1H-imidazol-5-yl)ethyl]-2,3-dihydrobenzothiophene-2-carboxamide (2S,3S)-3-chloro-N-[2-(1H-imidaz…
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) | 1.87 | 7.56 | -38.17 | 3 | 4 | 1 | 59 | 308.814 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.87 | 7.1 | -12.91 | 2 | 4 | 0 | 58 | 307.806 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.