In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 2nd, 2010 | 18 | No |
Popular Name: (2R)-2-(2,4-dichlorophenyl)-1-imidazol-1-yl-3-sulfanyl-propan-2-ol (2R)-2-(2,4-dichlorophenyl)-1-im…
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) | 2.62 | 7.14 | -37.8 | 2 | 3 | 1 | 39 | 304.222 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.62 | 7.15 | -44.68 | 1 | 3 | -1 | 38 | 302.206 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 6.62 | -8.82 | 1 | 3 | 0 | 38 | 303.214 | 4 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | US4526983 | IBM Patent Data |