In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 19 | Yes |
Popular Name: N-(4-Diethylamino-benzyl)-N',N'-dimethyl-propane-1,3-diamine N-(4-Diethylamino-benzyl)-N',N'-…
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CAS Number: 626216-51-1
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) | 2.65 | 8.28 | -33.9 | 2 | 3 | 1 | 20 | 264.437 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.65 | 8.38 | -64.27 | 3 | 3 | 0 | 21 | 265.445 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.65 | 9.73 | -25.15 | 4 | 3 | 0 | 25 | 266.453 | 9 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |