| PDB CCD ID: | O4Y |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C11 H10 N2 O3 |
| InChI: | InChI=1S/C11H10N2O3/c1-7(11(15)16)13-6-12-9-5-3-2-4-8(9)10(13)14/h2-7H,1H3,(H,15,16)/t7-/m1/s1 |
| InChIKey: | AOIOGRLXASIYJK-SSDOTTSWSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | C[C@@H](N1C=Nc2ccccc2C1=O)C(O)=O | | ACDLabs 12.01 | CC(C(O)=O)N2C=Nc1c(cccc1)C2=O | | CACTVS 3.385 | C[CH](N1C=Nc2ccccc2C1=O)C(O)=O | | OpenEye OEToolkits 2.0.7 | CC(C(=O)O)N1C=Nc2ccccc2C1=O | | OpenEye OEToolkits 2.0.7 | C[C@H](C(=O)O)N1C=Nc2ccccc2C1=O |
|
| Name: | (2R)-2-(4-oxoquinazolin-3(4H)-yl)propanoic acid |
| ZINC: | ZINC000000253691 |
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