Drug Details

Name:

CHEMBL43370

PubChem ID:

9810328

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C33H46N5O8PS/c1-48(45,46)38-27(15-7-10-18-34)30(39)37-29(19-23-11-3-2-4-12-23)47(43,44)22-33(16-8-9-17-33)32(42)36-28(31(40)41)20-24-21-35-26-14-6-5-13-25(24)26/h2-6,11-14,21,27-29,35,38H,7-10,15-20,22,34H2,1H3,(H,36,42)(H,37,39)(H,40,41)(H,43,44)/t27-,28-,29+/m0/s1

SMILES:

NCCCC[C@@H](C(=O)N[C@H](P(=O)(CC1(CCCC1)C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)O)Cc1ccccc1)NS(=O)(=O)C

Properties:

Formula:	C33H46N5O8PS	Atoms:	48
Molecular Weight:	703.786	Rotatable Bonds:	20
H-bond Acceptors:	12	H-bond Donors:	7
logP:	5.7962

Targets:

Name	Uniprot ID	Source	References	Interaction
Angiotensin-converting enzyme	ACE_HUMAN	BindingDB	-	shows
Neprilysin	NEP_HUMAN	BindingDB	-	shows
Neprilysin	NEP_RAT	BindingDB	-	shows

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Synonyms:

CHEBI:163416

CHEMBL43370

CID 9810328

CID9810328

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