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Name | CHEMBL2369781 |
---|---|
Molecular formula | C48H68N10O9 |
IUPAC name | (2S)-1-[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-3-hydroxy-2-(naphthalene-1-carbonylamino)propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]pentanoyl]-N-ethylpyrrolidine-2-carboxamide |
Molecular weight | 929.133 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 10 |
XlogP | 3.2 |
Synonyms | BDBM50227963 |
Inchi Key | DLMDUNYRDWXGDD-ONSKYXJOSA-N |
Inchi ID | InChI=1S/C48H68N10O9/c1-6-51-46(66)40-17-11-23-58(40)47(67)35(16-10-22-52-48(49)50)53-42(62)36(24-28(2)3)54-43(63)37(25-29(4)5)55-44(64)38(26-30-18-20-32(60)21-19-30)56-45(65)39(27-59)57-41(61)34-15-9-13-31-12-7-8-14-33(31)34/h7-9,12-15,18-21,28-29,35-40,59-60H,6,10-11,16-17,22-27H2,1-5H3,(H,51,66)(H,53,62)(H,54,63)(H,55,64)(H,56,65)(H,57,61)(H4,49,50,52)/t35-,36-,37+,38-,39-,40-/m0/s1 |
PubChem CID | 14557606 |
ChEMBL | CHEMBL2369781 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
63100 | Lutropin-choriogonadotropic hormone receptor | P16235 | Lhcgr | Rattus norvegicus (Rat) | 700 |
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