(1R,2S,5R)-1-amino-2-(((S)-2-amino-4-(methylthio)butanamido)methyl)-5-(2-boronoethyl)cyclohexane-1-carboxylic acid

ID: ALA5170454

Chembl Id: CHEMBL5170454

PubChem CID: 164549581

Max Phase: Preclinical

Molecular Formula: C15H30BN3O5S

Molecular Weight: 375.30

Names and Identifiers

Canonical SMILES:  CSCC[C@H](N)C(=O)NC[C@@H]1CC[C@@H](CCB(O)O)C[C@]1(N)C(=O)O

Standard InChI:  InChI=1S/C15H30BN3O5S/c1-25-7-5-12(17)13(20)19-9-11-3-2-10(4-6-16(23)24)8-15(11,18)14(21)22/h10-12,23-24H,2-9,17-18H2,1H3,(H,19,20)(H,21,22)/t10-,11-,12-,15+/m0/s1

Standard InChI Key:  FAAXPLPGKGINLR-JUFZMCDQSA-N

Alternative Forms

1. Parent:

   

   ALA5170454

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Molecule Features

Natural Product: No

Oral: No

Chemical Probe: No

Parenteral: No

Molecule Type:

Topical: No

First In Class: No

Black Box: No

Chirality: No

Availability: No

Prodrug: No

Calculated Properties

Molecular Weight: 375.30

Molecular Weight (Monoisotopic): 375.1999

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References

1. Rosse G..  (2022)  Amino-cyclohexane Carboxylic Acid Inhibitors of Arginase.,  13  (10.0): [PMID:36262385] [10.1021/acsmedchemlett.2c00395]

Source

Source(1):

• Scientific Literature