In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 1st, 2010 | 14 | No |
Popular Name: 1-(2-Chloroacetyl)-1,3-dihydro-2H-indol-2-one 1-(2-Chloroacetyl)-1,3-dihydro-2…
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CAS Number: 937606-68-3
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) | 1.28 | 5.62 | -8.26 | 0 | 3 | 0 | 37 | 209.632 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 3.76 | -10.84 | 1 | 3 | 0 | 42 | 209.632 | 1 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | WO1997042187A1 | IBM Patent Data |