PDB CCD ID: | ZA9 |
Number of entries in BioLiP: | 2 |
Chemical formula: | C13 H16 N2 |
InChI: | InChI=1S/C13H16N2/c1-4-11(10-3-2-7-14-9-10)12-6-8-15-13(12)5-1/h1,4-6,8,10,14-15H,2-3,7,9H2/t10-/m1/s1 |
InChIKey: | JWMGZQMVMZBMFM-SNVBAGLBSA-N |
SMILES: | Software | SMILES |
---|
OpenEye OEToolkits 2.0.7 | c1cc(c2cc[nH]c2c1)C3CCCNC3 | CACTVS 3.385 | C1CNC[CH](C1)c2cccc3[nH]ccc23 | CACTVS 3.385 | C1CNC[C@@H](C1)c2cccc3[nH]ccc23 | OpenEye OEToolkits 2.0.7 | c1cc(c2cc[nH]c2c1)[C@@H]3CCCNC3 | ACDLabs 12.01 | c1c[NH]c2cccc(c12)C1CCCNC1 |
|
Name: | 4-[(3S)-piperidin-3-yl]-1H-indole |
ZINC: | ZINC000033884898 |