GGTI-298

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H33N3O3S
Molecular Weight	479.634
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC(=O)[C@H](CC(C)C)NC(=O)C1=CC=C(NC[C@@H](N)CS)C=C1C2=C3C=CC=CC3=CC=C2

InChI

InChIKey=XVWPFYDMUFBHBF-CLOONOSVSA-N

InChI=1S/C27H33N3O3S/c1-17(2)13-25(27(32)33-3)30-26(31)23-12-11-20(29-15-19(28)16-34)14-24(23)22-10-6-8-18-7-4-5-9-21(18)22/h4-12,14,17,19,25,29,34H,13,15-16,28H2,1-3H3,(H,30,31)/t19-,25+/m1/s1

HIDE SMILES / InChI

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Geranylgeranyl transferase type I 7 Target ID: CHEMBL2095164 Sources: https://www.ncbi.nlm.nih.gov/pubmed/15745827	Inhibitor 8297		150.0 nM [IC50]

Name

Type

Language

GGTI-298

Code

English

GGTI298

Code

English

L-LEUCINE, N-(4-(((2R)-2-AMINO-3-MERCAPTOPROPYL)AMINO)-2-(1-NAPHTHALENYL)BENZOYL)-, METHYL ESTER

Systematic Name

English

(S)-METHYL 2-(4-(((R)-2-AMINO-3-MERCAPTOPROPYL)AMINO)-2-(NAPHTHALEN-1-YL)BENZAMIDO)-4-METHYLPENTANOATE

Systematic Name

English

L-LEUCINE, N-(4-((2-AMINO-3-MERCAPTOPROPYL)AMINO)-2-(1-NAPHTHALENYL)BENZOYL)-, METHYL ESTER, (R)-

Systematic Name

English

Code System Code Type Description

FDA UNII

ELA97V8Q7P

Created by admin on Sat Dec 16 18:59:19 GMT 2023 , Edited by admin on Sat Dec 16 18:59:19 GMT 2023

PRIMARY

PUBCHEM

9811606

Created by admin on Sat Dec 16 18:59:19 GMT 2023 , Edited by admin on Sat Dec 16 18:59:19 GMT 2023

PRIMARY

CAS

180977-44-0

Created by admin on Sat Dec 16 18:59:19 GMT 2023 , Edited by admin on Sat Dec 16 18:59:19 GMT 2023

PRIMARY

EPA CompTox

DTXSID70582025

Created by admin on Sat Dec 16 18:59:19 GMT 2023 , Edited by admin on Sat Dec 16 18:59:19 GMT 2023

PRIMARY

ACTIVE MOIETY


					ELA97V8Q7P

GGTI-298