Home Research COVID-19 Services Publications People Teaching Job Opening News Forum Lab Only
Online Services

●I-TASSER ●I-TASSER-MTD ●C-I-TASSER ●CR-I-TASSER ●QUARK ●C-QUARK ●LOMETS ●MUSTER ●CEthreader ●SEGMER ●DeepFold ●DeepFoldRNA ●FoldDesign ●COFACTOR ●COACH ●MetaGO ●TripletGO ●IonCom ●FG-MD ●ModRefiner ●REMO ●DEMO ●DEMO-EM ●SPRING ●COTH ●Threpp ●PEPPI ●BSpred ●ANGLOR ●EDock ●BSP-SLIM ●SAXSTER ●FUpred ●ThreaDom ●ThreaDomEx ●EvoDesign ●BindProf ●BindProfX ●SSIPe ●GPCR-I-TASSER ●MAGELLAN ●ResQ ●STRUM ●DAMpred

●TM-score ●TM-align ●US-align ●MM-align ●RNA-align ●NW-align ●LS-align ●EDTSurf ●MVP ●MVP-Fit ●SPICKER ●HAAD ●PSSpred ●3DRobot ●MR-REX ●I-TASSER-MR ●SVMSEQ ●NeBcon ●ResPRE ●TripletRes ●DeepPotential ●WDL-RF ●ATPbind ●DockRMSD ●DeepMSA ●FASPR ●EM-Refiner ●GPU-I-TASSER

●BioLiP ●E. coli ●GLASS ●GPCR-HGmod ●GPCR-RD ●GPCR-EXP ●Tara-3D ●TM-fold ●DECOYS ●POTENTIAL ●RW/RWplus ●EvoEF ●HPSF ●THE-DB ●ADDRESS ●Alpaca-Antibody ●CASP7 ●CASP8 ●CASP9 ●CASP10 ●CASP11 ●CASP12 ●CASP13 ●CASP14

You can:

Ligand

NameSA II
Molecular formulaC38H54N8O6
IUPAC name3-(7-aminoheptyl)-12-(3-aminopropyl)-6-benzyl-15-(1-hydroxyethyl)-9-(1H-indol-3-ylmethyl)-1,4,7,10,13-pentazacyclopentadecane-2,5,8,11,14-pentone
Molecular weight718.9
Hydrogen bond acceptor8
Hydrogen bond donor9
XlogP2.6
Synonymsc[Aha-Phe-D-Trp-Lys-Thr]
BDBM84639
Inchi KeyBOATUFWSEAYVSZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C38H54N8O6/c1-24(47)33-38(52)43-30(18-12-20-40)34(48)45-32(22-26-23-41-28-16-10-9-15-27(26)28)37(51)44-31(21-25-13-6-5-7-14-25)36(50)42-29(35(49)46-33)17-8-3-2-4-11-19-39/h5-7,9-10,13-16,23-24,29-33,41,47H,2-4,8,11-12,17-22,39-40H2,1H3,(H,42,50)(H,43,52)(H,44,51)(H,45,48)(H,46,49)
PubChem CID57339800
ChEMBLN/A
IUPHARN/A
BindingDB84639
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand is heavier than 500 daltons.

Known GPCRs

You can:

Total entries: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
28613Somatostatin receptor type 1P30872SSTR1Homo sapiens (Human)391
555593Somatostatin receptor type 2P30875Sstr2Mus musculus (Mouse)369
28610Somatostatin receptor type 3P30935Sstr3Mus musculus (Mouse)428
28612Somatostatin receptor type 4P30937Sstr4Rattus norvegicus (Rat)384
28611Somatostatin receptor type 5P35346SSTR5Homo sapiens (Human)364

zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417