6FD
pyrido[3,4-g]quinazoline-2,10-diamine
Created: | 2016-03-30 |
Last modified: | 2016-05-04 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 25 |
Chiral Atom Count | 0 |
Bond Count | 27 |
Aromatic Bond Count | 16 |
Chemical Component Summary | |
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Name | pyrido[3,4-g]quinazoline-2,10-diamine |
Systematic Name (OpenEye OEToolkits) | pyrido[3,4-g]quinazoline-2,10-diamine |
Formula | C11 H9 N5 |
Molecular Weight | 211.223 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c2c1cnc(N)nc1c(c3c2cncc3)N |
SMILES | CACTVS | 3.385 | Nc1ncc2cc3cnccc3c(N)c2n1 |
SMILES | OpenEye OEToolkits | 2.0.4 | c1cncc2c1c(c3c(c2)cnc(n3)N)N |
Canonical SMILES | CACTVS | 3.385 | Nc1ncc2cc3cnccc3c(N)c2n1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.4 | c1cncc2c1c(c3c(c2)cnc(n3)N)N |
InChI | InChI | 1.03 | InChI=1S/C11H9N5/c12-9-8-1-2-14-4-6(8)3-7-5-15-11(13)16-10(7)9/h1-5H,12H2,(H2,13,15,16) |
InChIKey | InChI | 1.03 | PQAQQDCVZZTPPJ-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 118988439 |
ChEMBL | CHEMBL3823483 |