In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 16 | Yes |
Popular Name: N-(3-Pyridinylmethyl)-3-piperidinecarboxamide hydrochloride N-(3-Pyridinylmethyl)-3-piperidi…
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CAS Numbers: 1220035-37-9 , N/A
3-piperidinecarboxamide, N-(3-pyridinylmethyl)-
N-(3-Pyridinylmethyl)-3-piperidinecarboxamidehydrochloride
N-(Pyridin-3-ylmethyl)piperidine-3-carboxamide 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) | -0.21 | 2.62 | -53.36 | 3 | 4 | 1 | 59 | 220.296 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.21 | 3.07 | -105.27 | 4 | 4 | 2 | 60 | 221.304 | 3 | ↓ |
Note Type | Comments | Provided By |
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Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.