You can:
Name | CHEMBL439880 |
---|---|
Molecular formula | C81H106N12O13 |
IUPAC name | (2R)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-naphthalen-2-ylpropanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]-3-hydroxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-6-(heptan-4-ylamino)hexanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]-N-[(2S)-1-amino-1-oxopropan-2-yl]pyrrolidine-2-carboxamide |
Molecular weight | 1455.81 |
Hydrogen bond acceptor | 14 |
Hydrogen bond donor | 13 |
XlogP | 8.9 |
Synonyms | N/A |
Inchi Key | TZBYYPYYBHJWBB-OQTVMXKLSA-N |
Inchi ID | InChI=1S/C81H106N12O13/c1-7-23-61(24-8-2)83-41-21-20-33-63(73(98)87-66(46-55-27-14-10-15-28-55)77(102)91-69(43-51(3)4)81(106)93-42-22-34-71(93)80(105)84-52(5)72(82)97)86-75(100)68(48-57-36-39-62(96)40-37-57)90-79(104)70(50-94)92-78(103)67(47-56-29-16-11-17-30-56)89-76(101)65(45-54-25-12-9-13-26-54)88-74(99)64(85-53(6)95)49-58-35-38-59-31-18-19-32-60(59)44-58/h9-19,25-32,35-40,44,51-52,61,63-71,83,94,96H,7-8,20-24,33-34,41-43,45-50H2,1-6H3,(H2,82,97)(H,84,105)(H,85,95)(H,86,100)(H,87,98)(H,88,99)(H,89,101)(H,90,104)(H,91,102)(H,92,103)/t52-,63-,64-,65-,66-,67-,68-,69-,70-,71+/m0/s1 |
PubChem CID | 44376791 |
ChEMBL | CHEMBL439880 |
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. This ligand has a partition coefficient log P greater than 5. |
You can:
GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
330977 | Lutropin-choriogonadotropic hormone receptor | P16235 | Lhcgr | Rattus norvegicus (Rat) | 700 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218