You can:
Name | CHEMBL407073 |
---|---|
Molecular formula | C64H80FN13O10 |
IUPAC name | (2S)-N-[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-5-(diaminomethylideneamino)-1-[(2R)-2-(ethylcarbamoyl)pyrrolidin-1-yl]-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-1-[(2S)-2-[3-(4-fluorophenyl)propanoylamino]-3-(1H-indol-3-yl)propanoyl]-4-hydroxypyrrolidine-2-carboxamide |
Molecular weight | 1210.42 |
Hydrogen bond acceptor | 12 |
Hydrogen bond donor | 12 |
XlogP | 4.5 |
Synonyms | N/A |
Inchi Key | BVMFWZALHZIKAK-GHGRYVAGSA-N |
Inchi ID | InChI=1S/C64H80FN13O10/c1-4-68-60(85)54-16-10-28-77(54)62(87)49(15-9-27-69-64(66)67)73-57(82)50(29-37(2)3)74-59(84)52(31-40-34-70-47-13-7-5-11-45(40)47)75-58(83)51(30-39-19-24-43(79)25-20-39)76-61(86)55-33-44(80)36-78(55)63(88)53(32-41-35-71-48-14-8-6-12-46(41)48)72-56(81)26-21-38-17-22-42(65)23-18-38/h5-8,11-14,17-20,22-25,34-35,37,44,49-55,70-71,79-80H,4,9-10,15-16,21,26-33,36H2,1-3H3,(H,68,85)(H,72,81)(H,73,82)(H,74,84)(H,75,83)(H,76,86)(H4,66,67,69)/t44?,49-,50-,51-,52+,53-,54+,55-/m0/s1 |
PubChem CID | 44375128 |
ChEMBL | CHEMBL407073 |
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. |
You can:
GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
33862 | Gonadotropin-releasing hormone receptor | P30969 | Gnrhr | Rattus norvegicus (Rat) | 327 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218