| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 12 | Yes |
Popular Name: 2-[(6-Chloro-pyridin-3-ylmethyl)-amino]-ethanol 2-[(6-Chloro-pyridin-3-ylmethyl)…
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CAS Number: 105827-84-7
| 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) | 0.65 | 0.63 | -46.01 | 3 | 3 | 1 | 50 | 187.65 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.65 | -0.79 | -7.14 | 2 | 3 | 0 | 45 | 186.642 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0192060A1; US4742060; US4845106; US5001138; US5204360; US5298507; US5428032; US5461167; US5580889; US5750704; US6022967 | IBM Patent Data |
