Drug Name |
Pyrazolo[1,5-a]pyrimidine derivative 29
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Synonyms |
PMID25470667-Compound-Figure5-18 |
Drug Type |
Small molecular drug
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Structure |
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3D MOL
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2D MOL
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#Ro5 Violations (Lipinski): 0 |
Molecular Weight (mw) |
291.35 |
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Logarithm of the Partition Coefficient (xlogp) |
2.5 |
Rotatable Bond Count (rotbonds) |
3 |
Hydrogen Bond Donor Count (hbonddonor) |
1 |
Hydrogen Bond Acceptor Count (hbondacc) |
3 |
Chemical Identifiers |
- Formula
- C17H17N5
- IUPAC Name
6-(1-propylindol-5-yl)pyrazolo[1,5-a]pyrimidin-7-amine
- Canonical SMILES
-
CCCN1C=CC2=C1C=CC(=C2)C3=C(N4C(=CC=N4)N=C3)N
- InChI
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InChI=1S/C17H17N5/c1-2-8-21-9-6-13-10-12(3-4-15(13)21)14-11-19-16-5-7-20-22(16)17(14)18/h3-7,9-11H,2,8,18H2,1H3
- InChIKey
-
WYJQPMFWZLKCBR-UHFFFAOYSA-N
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Cross-matching ID |
- PubChem CID
- 74221584
- TTD ID
- D0XT7O
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