| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2008 | 13 | Yes |
Popular Name: (S)-2-Amino-N-pyridin-3-ylmethyl-propionamide (S)-2-Amino-N-pyridin-3-ylmethyl…
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CAS Numbers: 1236261-24-7 , 864273-27-8 , N/A , [1236261-24-7]
2-Amino-N-(3-pyridinylmethyl)propanamide hydrochloride
2-Amino-N-(3-pyridinylmethyl)propanamidehydrochloride
2-Amino-N-(pyridin-3-ylmethyl)propanamide hydrochloride
| 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) | -1.21 | -4.41 | -44.64 | 4 | 4 | 1 | 70 | 180.231 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -1.21 | -4.3 | -90.24 | 5 | 4 | 2 | 71 | 181.239 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
