| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 18 | Yes |
Popular Name: N-[3-(Aminomethyl)-2-pyridinyl]-N-benzyl-N-ethylamine N-[3-(Aminomethyl)-2-pyridinyl]-…
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CAS Numbers: 1152523-40-4 , N/A , [1152523-40-4]
| 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) | 2.05 | 7.05 | -41.87 | 3 | 3 | 1 | 44 | 242.346 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 6.66 | -4.53 | 2 | 3 | 0 | 42 | 241.338 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.05 | 7.51 | -95.59 | 4 | 3 | 2 | 45 | 243.354 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
