You can:
Name | CHEMBL515145 |
---|---|
Molecular formula | C27H42N4O5 |
IUPAC name | (3S,6S,9S,12S)-3-benzyl-9,12-bis[(2S)-butan-2-yl]-6-[(2S,3R)-3-hydroxybutan-2-yl]-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone |
Molecular weight | 502.656 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 5 |
XlogP | 3.4 |
Synonyms | BDBM50256665 (3S,6S,9S,12S)-3-benzyl-9,12-di-sec-butyl-6-((2S,3R)-3-hydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-2,5,8,11-tetraone |
Inchi Key | PCZVRCIZMAPKOI-HMHHHFJXSA-N |
Inchi ID | InChI=1S/C27H42N4O5/c1-7-15(3)21-25(34)30-22(16(4)8-2)26(35)31-23(17(5)18(6)32)27(36)28-20(24(33)29-21)14-19-12-10-9-11-13-19/h9-13,15-18,20-23,32H,7-8,14H2,1-6H3,(H,28,36)(H,29,33)(H,30,34)(H,31,35)/t15-,16-,17+,18+,20-,21-,22-,23-/m0/s1 |
PubChem CID | 25154747 |
ChEMBL | CHEMBL515145 |
IUPHAR | N/A |
BindingDB | 50256665 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
You can:
GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
256754 | Galanin receptor type 1 | Q62805 | Galr1 | Rattus norvegicus (Rat) | 346 |
256753 | Galanin receptor type 2 | O08726 | Galr2 | Rattus norvegicus (Rat) | 372 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417