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Name | CHEMBL1802369 |
---|---|
Molecular formula | C42H57N11O7 |
IUPAC name | (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-3-phenylpropanoyl]amino]pentanoyl]amino]-3-phenylpropanoyl]amino]-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-5-(diaminomethylideneamino)pentanamide |
Molecular weight | 827.988 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 10 |
XlogP | 0.8 |
Synonyms | BDBM50347841 |
Inchi Key | SQAFYGAWIMWUON-LJADHVKFSA-N |
Inchi ID | InChI=1S/C42H57N11O7/c1-2-13-30(50-40(59)33(23-28-16-8-4-9-17-28)49-36(55)26-48-35(54)25-43)38(57)53-34(24-29-18-10-5-11-19-29)41(60)51-31(20-12-21-47-42(45)46)39(58)52-32(37(44)56)22-27-14-6-3-7-15-27/h3-11,14-19,30-34H,2,12-13,20-26,43H2,1H3,(H2,44,56)(H,48,54)(H,49,55)(H,50,59)(H,51,60)(H,52,58)(H,53,57)(H4,45,46,47)/t30-,31-,32-,33-,34-/m0/s1 |
PubChem CID | 53361221 |
ChEMBL | CHEMBL1802369 |
IUPHAR | N/A |
BindingDB | 50347841 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
320427 | Pyroglutamylated RF-amide peptide receptor | Q96P65 | QRFPR | Homo sapiens (Human) | 431 |
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