CHEMBRDG-BB 7990865
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CHEMBRDG-BB 7990865
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CAS No:
838843-11-1
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Formula:
C11H12N4O2S
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Chemical Name:
CHEMBRDG-BB 7990865
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Synonyms:
CHEMBRDG-BB 7990865;3-([4-METHYL-5-(4-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]THIO)PROPANOIC ACID;3-(4-METHYL-5-PYRIDIN-4-YL-4H-[1,2,4]TRIAZOL-3-YLSULFANYL)-PROPIONIC ACID;3-{[4-methyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio}propanoic acid(SALTDATA: FREE)
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CAS No:
Computed Properties
Molecular Weight:264.31
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:264.06809681
Monoisotopic Mass:264.06809681
Topological Polar Surface Area:106
Heavy Atom Count:18
Complexity:286
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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