In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2006 | 16 | Yes |
Popular Name: 2-(1-Azepanyl)nicotinic acid 2-(1-Azepanyl)nicotinic acid
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CAS Numbers: 571913-22-9 , [571913-22-9] , [57203-01-7]
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) | 2.08 | -0.24 | -49.53 | 1 | 4 | 0 | 57 | 220.272 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |