Therapeutic Targets Database
BIDD Pharmainformatics Databases
 
   
   

 

TTD Drug ID: DNC004266

Drug Information
NameF-G-G-F-T-G-MeA-R-K-S-A-R-K-L-A-N-Q-COOH
IndicationNot AvailableExperimental    
Structure

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InChI1S/C80H131N27O22/c1-42(2)34-55(73(123)95-44(4)66(116)103-57(37-60
(85)111)74(124)102-54(78(128)129)28-29-59(84)110)104-71(121)50(24
-14-16-30-81)100-69(119)52(26-18-32-90-79(86)87)98-65(115)43(3)96
-76(126)58(41-108)105-72(122)51(25-15-17-31-82)101-70(120)53(27-1
9-33-91-80(88)89)99-67(117)45(5)107(7)63(114)40-94-77(127)64(46(6
)109)106-75(125)56(36-48-22-12-9-13-23-48)97-62(113)39-92-61(112)
38-93-68(118)49(83)35-47-20-10-8-11-21-47/h8-13,20-23,42-46,49-58
,64,108-109H,14-19,24-41,81-83H2,1-7H3,(H2,84,110)(H2,85,111)(H,9
2,112)(H,93,118)(H,94,127)(H,95,123)(H,96,126)(H,97,113)(H,98,115
)(H,99,117)(H,100,119)(H,101,120)(H,102,124)(H,103,116)(H,104,121
)(H,105,122)(H,106,125)(H,128,129)(H4,86,87,90)(H4,88,89,91)/t43-
,44-,45-,46+,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,64-/m0/s1
InChIKeyAZDMRQCLZWWKEK-FKPOJLNCSA-N
Canonical SMILESCC(C)CC(C(=O)NC(C)C(=O)NC(CC(=O)N)C(=O)NC(CCC(=O)N)C(=O)O)NC(=O)C(CCCCN)
NC(=O)C(CCCN=C(N)N)NC(=O)C(C)NC(=O)C(CO)NC(=O)C(CCCCN)NC(=O)C(CCCN=C(N)
N)NC(=O)C(C)N(C)C(=O)CNC(=O)C(C(C)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)
CNC(=O)C(CC2=CC=CC=C2)N    
Isomeric SMILESC[C@H]([C@@H](C(=O)NCC(=O)N(C)[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@
@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N
[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N)C(=
O)N[C@@H](CCC(=O)N)C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)
[C@H](CC2=CC=CC=C2)N)O
TargetNociceptin receptorInhibitor[1]
Ref 1J Med Chem. 2002 Nov 21;45(24):5280-6.Novel, potent ORL-1 receptor agonist peptides containing alpha-Helix-promoting conformational constraints. To Reference



 

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