Bioactive Compound Details
| BioID | bio199811 |
|---|---|
| Name | DP[TYR(ME)2]AVP |
| ChEMBL ID | CHEMBL279570 |
| Molecular Formula | C49H70N14O12S2 |
| Molecular Weight | 1111.32 |
| Molecular Weight (Monoisotopic) | 1110.4739 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | None |
| Smiles | CN1C(=O)CC(C)(C)SSC[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]1Cc1ccc(O)cc1 |
| Inchi | InChI=1S/C49H70N14O12S2/c1-49(2)24-40(68)62(3)36(22-28-13-15-29(64)16-14-28)46(74)60-32(21-27-9-5-4-6-10-27)43(71)57-31(17-18-37(50)65)42(70)59-33(23-38(51)66)44(72)61-34(26-76-77-49)47(75)63-20-8-12-35(63)45(73)58-30(11-7-19-55-48(53)54)41(69)56-25-39(52)67/h4-6,9-10,13-16,30-36,64H,7-8,11-12,17-26H2,1-3H3,(H2,50,65)(H2,51,66)(H2,52,67)(H,56,69)(H,57,71)(H,58,73)(H,59,70)(H,60,74)(H,61,72)(H4,53,54,55)/t30-,31-,32+,33+,34+,35-,36-/m0/s1 |
| Inchi Key | VKZYIJGYODBAEG-SQTOMOOLSA-N |
| Molecular Species | None |
| Targets | 2.0 |
| Bioactivities | 3.0 |
| Np Likeness Score | None |
| Records Key | ['table II'] |
| Records Name | ['dp[Tyr(Me)2]AVP'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
