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Name | CHEMBL1802379 |
---|---|
Molecular formula | C43H60N12O7 |
IUPAC name | (2S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[bis(dimethylamino)methylideneamino]acetyl]amino]-3-phenylpropanoyl]amino]-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanamide |
Molecular weight | 857.03 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 9 |
XlogP | 0.2 |
Synonyms | BDBM50347856 |
Inchi Key | LYQBEHIYIHUDGI-ZZTWKDBPSA-N |
Inchi ID | InChI=1S/C43H60N12O7/c1-54(2)43(55(3)4)48-26-36(57)49-33(24-29-17-10-6-11-18-29)39(60)53-35(27-56)41(62)52-34(25-30-19-12-7-13-20-30)40(61)50-31(21-14-22-47-42(45)46)38(59)51-32(37(44)58)23-28-15-8-5-9-16-28/h5-13,15-20,31-35,56H,14,21-27H2,1-4H3,(H2,44,58)(H,49,57)(H,50,61)(H,51,59)(H,52,62)(H,53,60)(H4,45,46,47)/t31-,32-,33-,34-,35-/m0/s1 |
PubChem CID | 56676672 |
ChEMBL | CHEMBL1802379 |
IUPHAR | N/A |
BindingDB | 50347856 |
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 |
---|---|---|---|---|---|
199607 | Pyroglutamylated RF-amide peptide receptor | Q96P65 | QRFPR | Homo sapiens (Human) | 431 |
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