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Name | CHEMBL567039 |
---|---|
Molecular formula | C30H39N9O5 |
IUPAC name | (2R)-5-(diaminomethylideneamino)-2-[[(2R)-2-[[(2S)-2-[3-(4-hydroxyphenyl)propanoylamino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-phenylpropanoyl]amino]pentanamide |
Molecular weight | 605.7 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 8 |
XlogP | 0.1 |
Synonyms | (S)-5-guanidino-2-((R)-2-((S)-2-(3-(4-hydroxyphenyl)propanamido)-3-(1H-imidazol-5-yl)propanamido)-3-phenylpropanamido)pentanamide BDBM50301136 |
Inchi Key | FYUIPKSDJUFFLG-SDHSZQHLSA-N |
Inchi ID | InChI=1S/C30H39N9O5/c31-27(42)23(7-4-14-35-30(32)33)38-28(43)24(15-20-5-2-1-3-6-20)39-29(44)25(16-21-17-34-18-36-21)37-26(41)13-10-19-8-11-22(40)12-9-19/h1-3,5-6,8-9,11-12,17-18,23-25,40H,4,7,10,13-16H2,(H2,31,42)(H,34,36)(H,37,41)(H,38,43)(H,39,44)(H4,32,33,35)/t23-,24-,25+/m1/s1 |
PubChem CID | 45487416 |
ChEMBL | CHEMBL567039 |
IUPHAR | N/A |
BindingDB | 50301136 |
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 |
---|---|---|---|---|---|
90566 | Melanocortin receptor 5 | P41149 | Mc5r | Mus musculus (Mouse) | 325 |
90567 | Melanocyte-stimulating hormone receptor | Q01727 | Mc1r | Mus musculus (Mouse) | 315 |
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