| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 14 | Yes |
Popular Name: N1-Ethyl-N3-(3-pyridinylmethyl)-1,3-propanediamine N1-Ethyl-N3-(3-pyridinylmethyl)-…
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CAS Number: 932206-77-4
| 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) | 0.34 | 2.97 | -39.44 | 3 | 3 | 1 | 42 | 194.302 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.34 | 4.64 | -182.98 | 5 | 3 | 3 | 47 | 196.318 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
