PDB CCD ID: | 4TT |
Number of entries in BioLiP: | 1 |
Chemical formula: | C14 H13 N3 |
InChI: | InChI=1S/C14H13N3/c1-2-7-12-10(5-1)11-6-3-4-9-8-15-17-13(9)14(11)16-12/h1-2,5,7-8,16H,3-4,6H2,(H,15,17) |
InChIKey: | HBWXPQZQCDQNND-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.370 | C1Cc2cn[nH]c2c3[nH]c4ccccc4c3C1 | OpenEye OEToolkits 1.7.2 | c1ccc2c(c1)c3c([nH]2)-c4c(cn[nH]4)CCC3 | ACDLabs 12.01 | n4cc3c(c2c(c1ccccc1n2)CCC3)n4 |
|
Name: | 4,5,6,11-tetrahydro-1H-pyrazolo[4',3':6,7]cyclohepta[1,2-b]indole |
ChEMBL: | CHEMBL1929485 |
ZINC: | ZINC000082155336 |