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Name | 311309-27-0 |
---|---|
Molecular formula | C45H72N14O10 |
IUPAC name | (2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-4-amino-2-[[(2S)-1-[(2S)-2-amino-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]-4-oxobutanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-N-[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]pentanediamide |
Molecular weight | 969.159 |
Hydrogen bond acceptor | 12 |
Hydrogen bond donor | 11 |
XlogP | -2.5 |
Synonyms | ZINC169289418 Neuropeptide NPVF BDBM50029188 RFRP 3 (human) CHEMBL2165920 [ Show all ] |
Inchi Key | JFZCLMZUABKABL-GVCDGELBSA-N |
Inchi ID | InChI=1S/C45H72N14O10/c1-24(2)21-31(57-40(65)30(23-35(47)61)56-42(67)33-15-10-20-59(33)44(69)36(48)25(3)4)43(68)58-19-9-14-32(58)41(66)54-28(16-17-34(46)60)39(64)53-27(13-8-18-52-45(50)51)38(63)55-29(37(49)62)22-26-11-6-5-7-12-26/h5-7,11-12,24-25,27-33,36H,8-10,13-23,48H2,1-4H3,(H2,46,60)(H2,47,61)(H2,49,62)(H,53,64)(H,54,66)(H,55,63)(H,56,67)(H,57,65)(H4,50,51,52)/t27-,28-,29-,30-,31-,32-,33-,36-/m0/s1 |
PubChem CID | 71451611 |
ChEMBL | CHEMBL2165920 |
IUPHAR | N/A |
BindingDB | 50029188, 86143 |
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. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
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150045 | Neuropeptide FF receptor 1 | Q9GZQ6 | NPFFR1 | Homo sapiens (Human) | 430 |
150043 | Neuropeptide FF receptor 2 | Q9Y5X5 | NPFFR2 | Homo sapiens (Human) | 522 |
150044 | Neuropeptide FF receptor 2 | Q9EQD2 | Npffr2 | Rattus norvegicus (Rat) | 417 |
556049 | Prolactin-releasing peptide receptor | P49683 | PRLHR | Homo sapiens (Human) | 370 |
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