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Gene Set: D4 : CTD - olcegepant


Collection D4 : CTD
Chemical Name olcegepant ( From PubChem : OLCEGEPANT )
FDA NPC WHO Indian Australia China Traditional
Herbal
Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight
Hydrogen Bond
Donor Count
Hydrogen Bond
Acceptor Count
cLogP Lipinski Rule
869.645 g/mol 5 14 5.9064 False(1/4)
Structure
InChI InChI=1S/C38H47Br2N9O5/c39-29-21-25(22-30(40)34(29)50)23-33(45-37(53)48-15-10-28(11-16-48)49-24-26-5-1-2-6-31(26)44-38(49)54)35(51)43-32(7-3-4-12-41)36(52)47-19-17-46(18-20-47)27-8-13-42-14-9-27/h1-2,5-6,8-9,13-14,21-22,28,32-33,50H,3-4,7,10-12,15-20,23-24,41H2,(H,43,51)(H,44,54)(H,45,53)/t32-,33+/m0/s1
InChIKey ITIXDWVDFFXNEG-JHOUSYSJSA-N
Links

Gene (1 / 2)


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Source Type Unit Value Gene PMID Assay Other
CTDaffects(binding)CALCRL
C492454
CTDdecreases(activity)CALCRL
C492454
Download gene sets gmt, text, Detailed text
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