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Name | Corticotropin-releasing factor receptor 2 |
---|---|
Species | Mus musculus (Mouse) |
Gene | Crhr2 |
Synonym | CRFR-2 CRFR2 CRFR2alpha CRFR2beta CRH-R-2 [ Show all ] |
Disease | N/A for non-human GPCRs |
Length | 411 |
Amino acid sequence | MDAALLLSLLEANCSLALAEELLLDGWGVPPDPEGPYTYCNTTLDQIGTCWPQSAPGALVERPCPEYFNGIKYNTTRNAYRECLENGTWASRVNYSHCEPILDDKQRKYDLHYRIALIVNYLGHCVSVVALVAAFLLFLVLRSIRCLRNVIHWNLITTFILRNIAWFLLQLIDHEVHEGNEVWCRCITTIFNYFVVTNFFWMFVEGCYLHTAIVMTYSTEHLRKWLFLFIGWCIPCPIIIAWAVGKLYYENEQCWFGKEAGDLVDYIYQGPVMLVLLINFVFLFNIVRILMTKLRASTTSETIQYRKAVKATLVLLPLLGITYMLFFVNPGEDDLSQIVFIYFNSFLQSFQGFFVSVFYCFFNGEVRAALRKRWHRWQDHHALRVPVARAMSIPTSPTRISFHSIKQTAAV |
UniProt | Q60748 |
Protein Data Bank | 2jnd |
GPCR-HGmod model | N/A |
3D structure model | This structure is from PDB ID 2jnd. |
BioLiP | BL0101313 |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL2253 |
IUPHAR | 213 |
DrugBank | N/A |
Name | CHEMBL3775192 |
---|---|
Molecular formula | C174H292N50O49 |
IUPAC name | (4S)-5-[[(2S)-5-amino-1-[[1-[[(2S)-1-[[(2S)-5-amino-1-[[(6S,9S,18S)-18-[[(2S)-4-amino-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[1-[[(2S)-1-[[1-[[(2S,3S)-1-amino-3-methyl-1-oxopentan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-1,4-dioxobutan-2-yl]carbamoyl]-3,3,6-trimethyl-2,5,8,12-tetraoxo-1,4,7,13-tetrazacyclooctadec-9-yl]amino]-1,5-dioxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-4-[[(2S)-2-[[(2S)-5-carbamimidamido-2-[[(2S)-2-[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-carbamimidamido-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-3-carboxy-2-(pentanoylamino)propanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]-3-phenylpropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]pentanoyl]amino]-4-carboxybutanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-4-carboxybutanoyl]amino]hexanoylamino]propanoyl]amino]pentanoyl]amino]propanoyl]amino]-5-oxopentanoic acid |
Molecular weight | 3868.55 |
Hydrogen bond acceptor | 54 |
Hydrogen bond donor | 55 |
XlogP | -6.8 |
Synonyms | BDBM50153578 |
Inchi Key | SPKMMKNDFAUNGC-XWEKVXJNSA-N |
Inchi ID | InChI=1S/C174H292N50O49/c1-29-33-48-100(200-151(256)110(60-67-129(233)234)207-155(260)117(78-89(11)12)216-164(269)133(91(15)16)219-152(257)111(61-68-130(235)236)206-146(251)105(54-45-74-190-171(184)185)203-154(259)115(76-87(7)8)211-156(261)116(77-88(9)10)212-158(263)120(81-99-84-186-85-191-99)214-157(262)119(80-98-46-37-36-38-47-98)217-165(270)135(97(22)225)220-161(266)118(79-90(13)14)213-160(265)122(83-132(239)240)196-127(230)55-35-31-3)141(246)192-93(18)137(242)197-103(52-43-72-188-169(180)181)142(247)193-94(19)138(243)199-109(59-66-128(231)232)150(255)208-112(57-64-124(177)227)162(267)223-172(23,24)166(271)195-95(20)139(244)198-107(56-63-123(176)226)149(254)205-108-58-65-126(229)187-71-42-40-51-106(218-167(272)173(25,26)222-140(245)96(21)194-143(108)248)148(253)215-121(82-125(178)228)159(264)204-104(53-44-73-189-170(182)183)145(250)201-102(50-39-41-70-175)147(252)210-114(75-86(5)6)153(258)202-101(49-34-30-2)144(249)209-113(62-69-131(237)238)163(268)224-174(27,28)168(273)221-134(136(179)241)92(17)32-4/h36-38,46-47,84-97,100-122,133-135,225H,29-35,39-45,48-83,175H2,1-28H3,(H2,176,226)(H2,177,227)(H2,178,228)(H2,179,241)(H,186,191)(H,187,229)(H,192,246)(H,193,247)(H,194,248)(H,195,271)(H,196,230)(H,197,242)(H,198,244)(H,199,243)(H,200,256)(H,201,250)(H,202,258)(H,203,259)(H,204,264)(H,205,254)(H,206,251)(H,207,260)(H,208,255)(H,209,249)(H,210,252)(H,211,261)(H,212,263)(H,213,265)(H,214,262)(H,215,253)(H,216,269)(H,217,270)(H,218,272)(H,219,257)(H,220,266)(H,221,273)(H,222,245)(H,223,267)(H,224,268)(H,231,232)(H,233,234)(H,235,236)(H,237,238)(H,239,240)(H4,180,181,188)(H4,182,183,189)(H4,184,185,190)/t92-,93-,94-,95-,96-,97+,100?,101?,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119+,120-,121-,122-,133-,134-,135-/m0/s1 |
PubChem CID | 127029856 |
ChEMBL | CHEMBL3775192 |
IUPHAR | N/A |
BindingDB | 50153578 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 0.32 nM | PMID26789203 | ChEMBL |
Ki | 0.32 nM | PMID26789203 | BindingDB |
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