Bioactive Compound Details

BioIDbio199169
NameFELYPRESSIN
ChEMBL IDCHEMBL3989781
Molecular FormulaC46H65N13O11S2
Molecular Weight1040.24
Molecular Weight (Monoisotopic)1039.4368
TypeProtein
Max PhasePhase 2
Target IDTar81
Target NameNone
SynonymsFELIPRESINA|FELYPRESSIN|FELYPRESSINE|PLV-2
SmilesNCCCC[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(N)=O
InchiInChI=1S/C46H65N13O11S2/c47-18-8-7-14-29(40(64)52-23-38(51)62)54-45(69)35-15-9-19-59(35)46(70)34-25-72-71-24-28(48)39(63)55-31(20-26-10-3-1-4-11-26)43(67)56-32(21-27-12-5-2-6-13-27)42(66)53-30(16-17-36(49)60)41(65)57-33(22-37(50)61)44(68)58-34/h1-6,10-13,28-35H,7-9,14-25,47-48H2,(H2,49,60)(H2,50,61)(H2,51,62)(H,52,64)(H,53,66)(H,54,69)(H,55,63)(H,56,67)(H,57,65)(H,58,68)/t28-,29+,30-,31-,32-,33-,34-,35-/m0/s1
Inchi KeySFKQVVDKFKYTNA-OGNLOKFRSA-N
Molecular SpeciesNone
Targets1.0
Bioactivities3.0
Np Likeness ScoreNone
Records Key['Octapressin', 'FELYPRESSIN', 'FELYPRESSIN']
Records Name['Octapressin', 'FELYPRESSIN', 'FELYPRESSIN']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure