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Name | Ac-RYYRWK-NH2 |
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Molecular formula | C49H69N15O9 |
IUPAC name | (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-5-(diaminomethylideneamino)pentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-6-aminohexanamide |
Molecular weight | 1012.19 |
Hydrogen bond acceptor | 12 |
Hydrogen bond donor | 15 |
XlogP | -1.3 |
Synonyms | Ac-Arg-Tyr-Tyr-Arg-Trp-Lys-NH(2) CAS_200959-47-3 SCHEMBL13097862 200959-47-3 AKOS024456566 [ Show all ] |
Inchi Key | YROQVQIJRORFAZ-SKGSPYGFSA-N |
Inchi ID | InChI=1S/C49H69N15O9/c1-28(65)59-37(11-6-22-56-48(52)53)43(69)62-40(25-30-15-19-33(67)20-16-30)46(72)63-39(24-29-13-17-32(66)18-14-29)45(71)61-38(12-7-23-57-49(54)55)44(70)64-41(26-31-27-58-35-9-3-2-8-34(31)35)47(73)60-36(42(51)68)10-4-5-21-50/h2-3,8-9,13-20,27,36-41,58,66-67H,4-7,10-12,21-26,50H2,1H3,(H2,51,68)(H,59,65)(H,60,73)(H,61,71)(H,62,69)(H,63,72)(H,64,70)(H4,52,53,56)(H4,54,55,57)/t36-,37-,38-,39-,40-,41-/m0/s1 |
PubChem CID | 9811889 |
ChEMBL | CHEMBL2403218 |
IUPHAR | N/A |
BindingDB | 85191 |
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. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
417538 | Nociceptin receptor | P35370 | Oprl1 | Rattus norvegicus (Rat) | 367 |
557214 | Nociceptin receptor | P35377 | Oprl1 | Mus musculus (Mouse) | 367 |
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