In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2005 | 18 | Yes |
Popular Name: [1-(4-Methoxy-phenyl)-ethyl]-pyridin-2-ylmethyl-amine [1-(4-Methoxy-phenyl)-ethyl]-pyr…
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CAS Number: 626216-06-6
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) | 2.34 | -0.07 | -40.23 | 2 | 3 | 1 | 38 | 243.33 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.34 | -0.02 | -113.22 | 3 | 3 | 2 | 39 | 244.338 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |