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Structure
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| Relationships |
Total Number of functionally related protein(s) :
106
Total Number of Articles : 158
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| PubChem |
2678
|
| Molecular Formula |
C21H25ClN2O3 |
| SMILES |
C1CN(CCN1CCOCC(=O)O)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl |
| InChI |
InChI=1S/C21H25ClN2O3/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26/h1-9,21H,10-16H2,(H,25,26) |
| synonyms |
- cetirizine
- 83881-51-0
- Cetirizina
- Cetryn
- Ziptek
- Setir
- Cetirizinum
- Cetirizin
- Hitrizin Film Tablet
- Cetirizinum [Latin]
- AC-170
- UNII-YO7261ME24
- CHEBI:3561
- HSDB 7739
- YO7261ME24
- (2-(4-((4-Chlorophenyl)phenylmethyl)-1-piperazinyl)ethoxy)acetic acid
- DTXSID4022787
- Cetirizinum (Latin)
- (2-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}ethoxy)acetic acid
- Acetic acid, (2-(4-((4-chlorophenyl)phenylmethyl)-1-piperazinyl)ethoxy)-
- Acetic acid, [2-[4-[(4-chlorophenyl)phenylmethyl]-1-piperazinyl]ethoxy]-
- (2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)ethoxy)acetic acid
- [2-[4-[(4-chlorophenyl)phenylmethyl]-1-piperazinyl]ethoxy]acetic acid
- DTXCID802787
- R06AE07
- (+-)-(2-(4-(P-CHLORO-A-PHENYLBENZYL)-1-PIPERAZINYL)ETHOXY)ACETIC ACID
- ACETIC ACID, (2-(4-((4-CHLOROPHENYL)PHENYLMETHYL)-1-PIPERAZINYL)ETHOXY)-, (+-)-
- Virlix
- Cetiderm
- 2-(2-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}ethoxy)acetic acid
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| Properties |
| Property |
Value |
| MW |
388.9 g/mol |
| HBD |
1 |
| HBA |
5 |
| Rotatable Bond Count |
8 |
| Exact Mass |
388.1553704 g/mol |
| Monoisotopic Mass |
388.1553704 g/mol |
| Heavy Atom Count |
27 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
1 |
| Covalent Unit Count |
1 |
| Complexity |
443 |
| xlogp |
1.7 |
| Topological Polar Surface Area |
53 |
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