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1185763-69-2 molecular structure
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6-{[6-(1-methyl-1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]methyl}quinoline

ChemBase ID: 312718
Molecular Formular: C20H16N6
Molecular Mass: 340.38124
Monoisotopic Mass: 340.14364454
SMILES and InChIs

SMILES:
c1c(nn2c(c1)ncc2Cc1ccc2c(c1)cccn2)c1cnn(c1)C
Canonical SMILES:
Cn1ncc(c1)c1ccc2n(n1)c(cn2)Cc1ccc2c(c1)cccn2
InChI:
InChI=1S/C20H16N6/c1-25-13-16(11-23-25)19-6-7-20-22-12-17(26(20)24-19)10-14-4-5-18-15(9-14)3-2-8-21-18/h2-9,11-13H,10H2,1H3
InChIKey:
RNCNPRCUHHDYPC-UHFFFAOYSA-N

Cite this record

CBID:312718 http://www.chembase.cn/molecule-312718.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
6-{[6-(1-methyl-1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]methyl}quinoline
IUPAC Traditional name
6-{[6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]methyl}quinoline
Synonyms
NVP-BVU972
CAS Number
1185763-69-2

DATA SOURCES

DATA SOURCES

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Data Source Data ID
Selleck Chemicals S2761 external link Add to cart
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CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 3.0767064  LogD (pH = 7.4) 3.1267796 
Log P 3.1274507  Molar Refractivity 121.1312 cm3
Polarizability 39.946056 Å3 Polar Surface Area 60.9 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Pharmacology Properties Product Information Bioassay(PubChem)
Target
c-Met expand Show data source
Salt Data
Free Base expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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