UCSF

ZINC53007017

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2010 30 No

Popular Name: Ramipril Ramipril

Find On: PubMed — Wikipedia — Google

CAS Numbers: 87333-19-5 , [87333-19-5]

Other Names:

(2 S ,3 aS ,6 aS )-1[( S )-N-[( S )-1-Carboxy-3-phenylpropyl] alanyl] octahydrocyclopenta [ b ]pyrrole-2-carboxylic acid, 1-ethyl ester

(2 S ,3 aS ,6 aS )-1[( S )-N-[( S )-1-Carboxy-3-phenylpropyl] alanyl] octahydrocyclopenta [ b ]pyrrole-2-carboxylic acid, 1-ethyl ester; (2S,3aS,6aS)-1-((S)-N-((S)-1-Carboxy-3-phenylpropyl)alanyl)octahydrocyclopenta(b)pyrrole-2-carboxylic acid, 1-ethyl es

(2s,3as,6as)-1((s)-n-((s)-1-carboxy-3-phenylpropyl)alanyl)octahydrocyclopenta(b)pyrrole-2-carboxylic

(2S,3aS,6aS)-1-((S)-2-((S)-1-ethoxy-1-oxo-4-phenylbutan-2-ylamino)propanoyl) octahydrocyclopenta[b]pyrrole-2-carboxylic acid

(2s,3as,6as)-1-((s)-2-((s)-1-ethoxy-1-oxo-4-phenylbutan-2-ylamino)propanoyl)-octahydrocyclopenta[b]p

(2S,3aS,6aS)-1-((S)-N-((S)-1-Carboxy-3-phenylpropyl)alanyl)octahydrocyclopenta(b)pyrrole-2-carboxylic acid, 1-ethyl ester

(2S,3aS,6aS)-1-((S)-N-((S)-1-Ethoxycarbonyl-3-phenylpropyl)alanyl)octahydrocyclopenta(b)pyrrol-2-carbonsaeure

(2S,3aS,6aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole-2-carboxylic acid

(2S,3aS,6aS)-1-[(2S)-2-{[(1S)-1-ethoxycarbonyl-3-phenylpropyl]amino}propanoyl]octahydrocyclopenta[b]pyrrole-2-carboxylic acid

(2S,3aS,6aS)-1-[(2S)-2-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}propanoyl]-octahydrocyclopenta[b]pyrrole-2-carboxylic acid

(2S,3aS,6aS)-1-[(2S)-2-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}propanoyl]octahydrocyclopenta[b]pyrrole-2-carboxylic acid (non-preferred name)

(2s,3as,6as)-1-[(s)-2-((s)-1-ethoxycarbonyl-3-phenyl-propylamino)-propionyl]-octahydro-cyclopenta[b]

(2S,3aS,6aS)-1-[(S)-2-((S)-1-Ethoxycarbonyl-3-phenyl-propylamino)-propionyl]-octahydro-cyclopenta[b]pyrrole-2-carboxylic acid

(2S-(1(R*(R*)),2alpha,3abeta,6abeta))-1-(2-((1-(Ethoxycarbonyl)-3-phenylpropyl)amino)-1-oxopropyl)octahydrocyclopenta(b)pyrrole-2-carboxylic acid.

(2S-(1(R*(R*)),2alpha,3abeta,6abeta))-1-(2-((1-(Ethoxycarbonyl)-3-phenylpropyl)amino)-1-oxopropyl)octahydrocyclopenta(b)pyrrole-2-carboxylic acid; Altace (TN); Ramipril; Ramiprilum; Tritace

pril

126613-39-6

87333-19-5

87333-19-5; Altace (TN); D00421; Ramipril (USP/INN)

AC-1347

AC1NSFPR

Acovil

Almirall Brand of Ramipril

Altace

Altace (TN)

Astra Brand of Ramipril

AstraZeneca Brand of Ramipril

Aventis Brand of Ramipril

Aventis Pharma Brand of Ramipril

BAN

BIDD:GT0803

Bio-0651

BRD-A65739223-001-03-7

BSPBio_003347

C23H32N2O5

Carasel

Cardace

CHEBI:289203

CHEBI:8774

CHEMBL1168

CID5362129

CPD000466386

CPD000466386; RAMIPRIL

CPD000466386; RAMIPRIL; SAM002699899

Cyclopenta(b)pyrrole-2-carboxylic acid, 1-(2-((1-(ethoxycarbonyl)-3-phenylpropyl)amino)-1-oxopropyl)octahydro-, (2S(1(R*(R*)),2alpha,3abeta,6abeta))-

Cyclopenta(b)pyrrole-2-carboxylic acid, 1-(2-((1-(ethoxycarbonyl)-3-phenylpropyl)amino)-1-oxopropyl)octahydro-, (2S-(1(R*(R*)),2alpha,3abeta,6abeta))-

D00421

D017257

DAP000581

DB00178

Delix

FDA

HMS2051E04

HMS2090L11

HMS2093M10

HOE 498

HOE-498

HOE498

Hoechst Brand of Ramipril

Hypren

Hytren

INN

KBio2_002504

KBio2_005072

KBio2_007640

KBio3_002849

KBioGR_001858

KBioSS_002512

Lostapres

LS-58199

MFCD00865775

MLS000759523

MLS001216547

MLS001423965

MolPort-001-736-571

Monarch Brand of Ramipril

N-(1S-carboethoxy-3-phenylpropyl)-S-alanyl-cis,endo-2-azabicyclo[3.3.0]octane-3S-carboxylic Acid

Naprix

NCGC00178127-01

Pramace

Pramace (discontinued)

Promed Brand of Ramipril

QA-3745

Quark

R0404_SIGMA

Ramace

Ramipril (Altace)

Ramipril (BAN

Ramipril (FDA

Ramipril (USP/INN)

Ramipril [USAN:INN:BAN]

Ramiprilum

Ramiprilum [Latin]

Ramipro, Tritace, Altace, Prilace, Ramipril

S1793_Selleck

SAM001246757

SAM002699899

SMR000466386

SPECTRUM1505214

Spectrum3_001794

Spectrum4_001269

Spectrum5_001721

Spectrum_001958

STK801937

Triatec

Tritace

UNII-L35JN3I7SJ

Unipril

USAN

USP)

Vesdil

Zabien

[2s,3as,6as]-1-[(2s)-2-[[(1s)-1-(ethoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]octahydrocyclopen

[2S,3aS,6aS]-1-[(2S)-2-[[(1S)-1-(Ethoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]octahydrocyclopenta[b]pyrrole-2-carboxylic acid

Annotations

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 3.90e-02 g/l DrugBank-approved
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 99% APIChem
mechanism ACE inhibitor IBScreen Bioactives ZereneX Building Blocks
mechanism Angiotensin converting enzyme inhibitor IBScreen Bioactives
Indications antihypertensive KeyOrganics Bioactives
biological_use Antihypertensive agent IBScreen Bioactives ZereneX Building Blocks
Therapy antihypertensive, ACE inhibitor SMDC Iconix
Patent Database Links EP0795327; EP1514543; EP1541175; EP1553091; EP1559424; EP1579862; EP1611886; EP1627638; EP1629835; EP1671632; EP1681051; EP1723962; EP1741713; EP1746099; EP1776954; EP1785144; EP1790353; EP1832576; EP1859799; EP1862181; EP1889847; EP1894567; EP1908469; EP ChEBI
biological_use Hypotensive IBScreen Bioactives
PUBCHEM_SUBSTANCE_COMMENT NCC_SAMPLE_SUPPLIER : LightBiologicals; NCC_SUPPLIER_STRUCTURE_ID : MZ-3016; NCC_SUPPLIER_SAMPLE_COMMENTS : WHITE POWDER NIH Clinical Collection via PubChem
Target RAAS Selleck Chemicals
PUBCHEM_SUBSTANCE_COMMENT SAMPLE_SUPPLIER: LightBiologicals; SUPPLIER_STRUCTURE_ID: MZ-3016; SUPPLIER_COMMENTS: WHITE POWDER NIH Clinical Collection via PubChem

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
ACE-1-E Angiotensin-converting Enzyme (cluster #1 Of 1), Eukaryotic Eukaryotes 4 0.39 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
ACE_HUMAN P12821 Angiotensin-converting Enzyme, Human 4 0.39 Binding ≤ 1μM
ACE_HUMAN P12821 Angiotensin-converting Enzyme, Human 4 0.39 Binding ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Metabolism of Angiotensinogen to Angiotensins

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.