TVW
1H-pyrazolo[3,4-d]pyrimidin-4-amine
Created: | 2021-01-14 |
Last modified: | 2021-07-07 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 15 |
Chiral Atom Count | 0 |
Bond Count | 16 |
Aromatic Bond Count | 10 |
Chemical Component Summary | |
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Name | 1H-pyrazolo[3,4-d]pyrimidin-4-amine |
Synonyms | 2~{H}-pyrazolo[3,4-d]pyrimidin-4-amine |
Systematic Name (OpenEye OEToolkits) | 2~{H}-pyrazolo[3,4-d]pyrimidin-4-amine |
Formula | C5 H5 N5 |
Molecular Weight | 135.127 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | Nc1ncnc2n[nH]cc12 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1c2c(ncnc2n[nH]1)N |
Canonical SMILES | CACTVS | 3.385 | Nc1ncnc2n[nH]cc12 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | c1c2c(ncnc2n[nH]1)N |
InChI | InChI | 1.03 | InChI=1S/C5H5N5/c6-4-3-1-9-10-5(3)8-2-7-4/h1-2H,(H3,6,7,8,9,10) |
InChIKey | InChI | 1.03 | LHCPRYRLDOSKHK-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 75420 |
ChEMBL | CHEMBL388593 |