PPZ
Summary
Name: | 2-(PYRIDO[1,2-E]PURIN-4-YL)AMINO-ETHANOL |
Formula: | C11 H11 N5 O |
Formal charge: | 0 |
Formula weight: | 229.238 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 2-(pyrido[1,2-e]purin-4-ylamino)ethanol |
OpenEye OEToolkits | 1.5.0 | 2-(purino[9,8-a]pyridin-4-ylamino)ethanol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | OCCNc3ncnc2c3nc1ccccn12 |
SMILES_CANONICAL | CACTVS | 3.341 | OCCNc1ncnc2n3ccccc3nc12 |
SMILES | CACTVS | 3.341 | OCCNc1ncnc2n3ccccc3nc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccn2c(c1)nc3c2ncnc3NCCO |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccn2c(c1)nc3c2ncnc3NCCO |
InChI | InChI | 1.03 | InChI=1S/C11H11N5O/c17-6-4-12-10-9-11(14-7-13-10)16-5-2-1-3-8(16)15-9/h1-3,5,7,17H,4,6H2,(H,12,13,14) |
InChIKey | InChI | 1.03 | QBILBVYKWQWDQJ-UHFFFAOYSA-N |