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Name | B1 bradykinin receptor |
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Species | Rattus norvegicus (Rat) |
Gene | Bdkrb1 |
Synonym | KB1 bradykinin receptor BKR1 BK-1 receptor B1R [ Show all ] |
Disease | N/A for non-human GPCRs |
Length | 337 |
Amino acid sequence | MASEVLLELQPSNRSLQAPANITSCESALEDWDLLYRVLPGFVITICFFGLLGNLLVLSFFLLPWRQWWWQQRQRQQRLTIAEIYLANLAASDLVFVLGLPFWAENIGNRFNWPFGTDLCRVVSGVIKANLFVSIFLVVAISQDRYRLLVYPMTSWGYRRRRQAQATCLLIWVAGGLLSIPTFLLRSVKVVPDLNVSACILLFPHEAWHFARMVELNVLGFLLPVTAIIFFNYHILASLRGQKEASRTRCGGPKGSKTTGLILTLVASFLVCWCPYHFFAFLDFLVQVRVIQDCSWKEITDLGLQLANFFAFVNSCLNPLIYVFAGRLLKTRVLGTL |
UniProt | P97583 |
Protein Data Bank | N/A |
GPCR-HGmod model | N/A |
3D structure model | No available structures or models |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL4613 |
IUPHAR | 41 |
DrugBank | N/A |
Name | CHEMBL2370237 |
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Molecular formula | C45H76N14O10 |
IUPAC name | (2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-4-amino-2-[[1-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]butanoyl]amino]cycloheptanecarbonyl]amino]butanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoic acid |
Molecular weight | 973.191 |
Hydrogen bond acceptor | 15 |
Hydrogen bond donor | 14 |
XlogP | -5.5 |
Synonyms | N/A |
Inchi Key | CXIFKWQLQDGOCT-POFDKVPJSA-N |
Inchi ID | InChI=1S/C45H76N14O10/c46-21-9-6-14-29(49)36(61)53-30(15-10-24-52-44(50)51)37(62)54-32(18-23-48)39(64)58-45(19-7-1-2-8-20-45)43(69)57-31(17-22-47)38(63)56-34(27-60)41(66)59-25-11-16-35(59)40(65)55-33(42(67)68)26-28-12-4-3-5-13-28/h3-5,12-13,29-35,60H,1-2,6-11,14-27,46-49H2,(H,53,61)(H,54,62)(H,55,65)(H,56,63)(H,57,69)(H,58,64)(H,67,68)(H4,50,51,52)/t29-,30-,31-,32-,33-,34-,35-/m0/s1 |
PubChem CID | 73356114 |
ChEMBL | CHEMBL2370237 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|
pD2 | 4.3 - | PMID11170638 | ChEMBL |
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