In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 20 | Yes |
Popular Name: N-[(6S)-6-(dimethylamino)-6,7,8,9-tetrahydro-5H-carbazol-3-yl]acetamide N-[(6S)-6-(dimethylamino)-6,7,8,…
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) | 2.03 | 6.85 | -47.46 | 3 | 4 | 1 | 49 | 272.372 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.03 | 4.45 | -10.64 | 2 | 4 | 0 | 48 | 271.364 | 2 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | US4062864; US4172834; US4257952 | IBM Patent Data |