In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 19 | Yes |
Popular Name: 3-Chloro-N-(4-pyridinylmethyl)-5-(trifluoromethyl)-2-pyridinamine 3-Chloro-N-(4-pyridinylmethyl)-5…
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CAS Numbers: 1040046-12-5 , N/A
3-Chloro-N-(pyridin-4-ylmethyl)-5-(trifluoromethyl)pyridin-2-amine
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) | 2.51 | 6.27 | -4.78 | 1 | 3 | 0 | 38 | 287.672 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.51 | 6.71 | -38.82 | 2 | 3 | 1 | 39 | 288.68 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |