(R)-2-(9-allyl-3,6-bis(4-aminobutyl)-15,21-dibenzyl-18-cyclopentyl-23-(cyclopentylamino)-4,7,10,13,16,19,22-heptaoxo-12-((R)-1-phenylethyl)-3,6,9,12,15,18,21-heptaazatricosanamido)-3-mercaptopropanamide

ID: ALA3819565

Chembl Id: CHEMBL3819565

PubChem CID: 127050610

Max Phase: Preclinical

Molecular Formula: C62H90N12O9S

Molecular Weight: 1179.54

Molecule Type: Protein

Names and Identifiers

Canonical SMILES:  C=CCN(CC(=O)N(CCCCN)CC(=O)N(CCCCN)CC(=O)N[C@@H](CS)C(N)=O)C(=O)CN(C(=O)CN(Cc1ccccc1)C(=O)CN(C(=O)CN(Cc1ccccc1)C(=O)CNC1CCCC1)C1CCCC1)[C@H](C)c1ccccc1

Standard InChI:  InChI=1S/C62H90N12O9S/c1-3-33-68(40-57(78)70(35-20-18-32-64)41-56(77)69(34-19-17-31-63)39-54(75)67-53(46-84)62(65)83)58(79)44-73(47(2)50-25-11-6-12-26-50)60(81)42-72(38-49-23-9-5-10-24-49)59(80)45-74(52-29-15-16-30-52)61(82)43-71(37-48-21-7-4-8-22-48)55(76)36-66-51-27-13-14-28-51/h3-12,21-26,47,51-53,66,84H,1,13-20,27-46,63-64H2,2H3,(H2,65,83)(H,67,75)/t47-,53+/m1/s1

Standard InChI Key:  CQPRXDMWLPQHKY-WYDDVLLKSA-N

Alternative Forms

1. Parent:

   

   ALA3819565

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Molecule Features

Natural Product: No

Oral: No

Chemical Probe: No

Parenteral: No

Molecule Type: Protein

Topical: No

First In Class: No

Black Box: No

Chirality: No

Availability: No

Prodrug: No

Calculated Properties

Molecular Weight: 1179.54

Molecular Weight (Monoisotopic): 1178.6674

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References

1. Fu J, Xia A, Qi X..  (2016)  Identification of novel peptoid agonists of fibroblast growth factor receptor using microarray-based screening.,  7  (6): [PMID:27721968] [10.1039/c6md00121a]

Source

Source(1):

• Scientific Literature