Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L4I1AK
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| Ligand Name |
3-(3-chlorophenyl)-2-({(1S)-1-[(6S)-2,8-diazaspiro[5.5]undec-2-ylcarbonyl]pentyl}sulfanyl)quinazolin-4(3H)-one
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| Synonyms |
3-(3-chlorophenyl)-2-({(1S)-1-[(6S)-2,8-diazaspiro[5.5]undec-2-ylcarbonyl]pentyl}sulfanyl)quinazolin-4(3H)-one; Q27453627; 38M
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| Structure |
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Download2D MOL |
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| Formula |
C29H35ClN4O2S
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| Canonical SMILES |
CCCCC(C(=O)N1CCCC2(C1)CCCNC2)SC3=NC4=CC=CC=C4C(=O)N3C5=CC(=CC=C5)Cl
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| InChI |
1S/C29H35ClN4O2S/c1-2-3-13-25(27(36)33-17-8-15-29(20-33)14-7-16-31-19-29)37-28-32-24-12-5-4-11-23(24)26(35)34(28)22-10-6-9-21(30)18-22/h4-6,9-12,18,25,31H,2-3,7-8,13-17,19-20H2,1H3/t25-,29-/m0/s1
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| InChIKey |
GMBUMIBZLYNLLU-SVEHJYQDSA-N
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| PubChem Compound ID | ||||
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