In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 16 | Yes |
Popular Name: 2,3-Dichloro-N-(cyclohexylmethyl)aniline 2,3-Dichloro-N-(cyclohexylmethyl…
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CAS Number: 1036491-39-0
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) | 5.34 | 8.51 | -2.56 | 1 | 1 | 0 | 12 | 258.192 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |
PUBCHEM_PATENT_ID | US5955548; WO1998050344A1 | IBM Patent Data |