In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 15 | Yes |
Popular Name: [2-(diethylamino)ethyl](pyridin-4-ylmethyl)amine [2-(diethylamino)ethyl](pyridin-…
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CAS Number: 104293-70-1
None
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) | 0.99 | 6.12 | -120.65 | 3 | 3 | 2 | 34 | 209.337 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.99 | 2.67 | -3.54 | 1 | 3 | 0 | 28 | 207.321 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.99 | 4.61 | -37.41 | 2 | 3 | 1 | 29 | 208.329 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.99 | 4.04 | -44.94 | 2 | 3 | 1 | 33 | 208.329 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.99 | 5.05 | -79.93 | 3 | 3 | 2 | 31 | 209.337 | 7 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |