UCSF

ZINC00020259

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 12 Yes

Other Names:

( )-Pseudoephedrine

(+)-(1S,2S)-Pseudoephedrine

(+)-(1S,2S)-Pseudoephedrine; (+)-Pseudoephedrine; (+)-psi-Ephedrine; (+)-threo-Ephedrine; Isoephedrine; L(+)-psi-Ephedrine; L-(+)-Pseudoephedrine; Psi-ephedrin; Psi-ephedrine; d-Isoephedrine; d-Pseudoephedrine; d-psi-2-Methylamino-1-phenyl-1-propanol; d-p

(+)-(1S,2S)-Pseudoephedrine;(+)-Pseudoephedrine;(+)-psi-Ephedrine;(+)-threo-Ephedrine;(1S,2S)-(+)-Pseudoephedrine;(1S,2S)-Pseudoephedrine;1-Ephedrine ;2-(Methylamino)-1-phenyl-1-propanol;Besan;D-Isoephedrine;D-Pseudoephedrine;D-Pseudoephedrine base;D-Psi-

(+)-Pseudoephedrine

(+)-Pseudoephedrine hydrochloride; D-Pseudoephedrine hydrochloride; L(+)-Pseudoephedrine hydrochloride; d-(alpha-(1-Methylamino)ethyl)benzyl alcohol hydrochloride; d-Pseudoephedrine hydrochloride

(+)-Pseudoephedrine sulfate (2:1) (salt); 2C10H15NO.H2O4S; AFRINOL; Afrin Tablets; BROMPHERIL; Benzenemethanol, alpha-((1S)-1-(methylamino)ethyl)-, (alphaS)-,sulfate (2:1) (salt); Benzenemethanol, alpha-(1-(methylamino)ethyl)-, (S-(R*,R*))-, sulfate (2:1)

(+)-Pseudoephedrine; 90-82-4; C02765; Pseudoephedrine

(+)-psi-Ephedrine

(+)-threo-Ephedrine

(-)-ephedrine sulfate; (-)-ephedrine sulfate (2:1) (salt); (-)-erythro-1-Hydroxy-2-(methylamino)-1-phenylpropane sulfate; (1R,2S)-1-Phenyl-2-methylaminopropanol-1 sulfate; (1R,2S)-2-(methylamino)-1-phenylpropan-1-ol sulfate (2:1) (salt); (R-(R*,S*))-alpha

(1S,2S)-(+)-Pseudoephedrine

(1S,2s)-(+)-pseudoephedrine hydrochloride

(1S,2S)-(+)-Pseudoephedrine hydrochloride, 99+%

(1S,2S)-(+)-pseudoephedrine; 90-82-4; CPD-9954; pseudoephedrine

(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol

(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol; sulfuric acid

(1S,2S)-2-Methylamino-1-phenyl-1-propanol

(1S,2S)-Pseudoephedrine

(1S,2S)-Pseudoephedrine, polymer-bound

2-(Methylamino)-1-phenylpropan-1-ol hydrochloride

287636_ALDRICH

304-87-0

30987-59-8

345-78-8; D00485; Pseudoephedrine hydrochloride (USP); Sudafed (TN)

37577-31-4

436

649031_ALDRICH

7460-12-0; Afrinol (TN); D05649; Pseudoephedrine sulfate (USP)

90-82-4

90-82-4; Acunaso (TN); D08449; Neodurasina (TN); Pseudoephedrine (INN)

AC-20292

AC1L1NUA

Acunaso

Acunaso (TN)

Afrin

Afrinol

alpha-(1-(Methylamino)ethyl)benzyl alcohol

Balminil Decongestant Syrup

Benylin Decongestant

Benzenemethanol, alpha-((1S)-1-(methylamino)ethyl)-, (alpha-S)-

Benzenemethanol, alpha-((1S)-1-(methylamino)ethyl)-, (alpha-S)- (9CI)

Benzenemethanol, alpha-((1S)-1-(methylamino)ethyl)-, (alphaS)-

Benzenemethanol, alpha-(1-(methylamino)ethyl)-, (S-(R*,R*))-

Benzenemethanol, alpha-(1-(methylamino)ethyl)-, hydrochloride, (R*,R*)-(+-)-; LS-125925; dl-Pseudoephedrine hydrochloride

Besan

BIDD:GT0817

BRD-A54236247-003-02-7

BRD-K84175871-003-02-2

BSPBio_003261

C02765

C10H15NO

Cenafed

CHEBI:44

CHEBI:51209

CHEMBL1590

Chlor-Trimeton

CID7028

CPD-9954

D-Isoephedrine

D-Pseudoephedrine

d-psi-2-Methylamino-1-phenyl-1-propanol

d-psi-Ephedrine

D08449

DAP000195

DB00852

Decofed

Dimetapp Decongestant

Dimetapp Decongestant Pediatric Drops

DivK1c_000451

Drixoral N.D.

Drixoral Nasal Decongestant

Efidac 24

Efidac 24 Pseudoephedrine Hcl

Efidac/24

EINECS 202-018-6

Eltor 120

Ephedrin-hydrorhodanid [German]; Ephedrine, thiocyanate; LS-63976; alpha-(1-Methylaminoethyl)benzyl alcohol thiocyanate

Ephedrine

Genaphed

HSDB 3177

I01-8928

IDI1_000451

INN); Pseudoephedrine Sulfate (FDA

Isoephedrine

KBio1_000451

KBio2_001358

KBio2_003926

KBio2_006494

KBio3_002762

KBioGR_001763

KBioSS_001358

L(+)-psi-Ephedrine

L-(+)-Pseudoephedrine

LS-125922

LS-190404

LS-43085

Maxenal

MFCD00058088

MFCD00064256

MolPort-001-684-474

Myfedrine

NCGC00015408-01

NCGC00178180-01

NCI60_002955

Neodurasina

Neodurasina (TN)

NINDS_000451

Novafed

PDSP1_001347

Pedia Care

Pseudo

Pseudo 60's

Pseudo-12

Pseudoefedrina

Pseudoefedrina [INN-Spanish]

pseudoefedrina; pseudoephedrine; pseudoephedrinum

Pseudoephedrine (BAN

Pseudoephedrine (D)

Pseudoephedrine (INN)

Pseudoephedrine D-Form

Pseudoephedrine Ephedrine

Pseudoephedrine Hcl

Pseudoephedrine Hydrochloride

Pseudoephedrine Sulfate

Pseudoephedrine [INN:BAN]

Pseudoephedrine, (+)-

Pseudoephedrine, L-(+)-

Pseudoephedrinum

Pseudoephedrinum [INN-Latin]

Pseudophed

Psi-Ephedrin

Psi-Ephedrine

psi-Ephedrine, (+)-

RACEPHEDRINE HYDROCHLORIDE

Robidrine

SCH-4855

SPBio_001365

Spectrum2_001303

Spectrum3_001771

Spectrum4_001162

Spectrum5_000650

Spectrum_000878

STOCK1N-42675

Sudafed

Sudafed 12 Hour

Sudafed Decongestant

Sudafed Decongestant 12 Hour

Sudafed Decongestant Extra Strength

Trans-Ephedrine

Triaminic AM Decongestant Formula

Triaminic Infant Oral Decongestant Drops

UNII-7CUC9DDI9F

USAN

USAN)

USAN); Pseudoephedrine HCl (FDA

USAN); Pseudoephedrine Polistirex (FDA

USP

USP)

USP); Pseudoephedrine Hydrochloride (FDA

USP); Pseudoephedrine Polistirex (FDA

Download: MOL2 SDF SMILES Flexibase

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
Ref Reference (pH 7) 1.24 3.1 -36.72 3 2 1 37 166.244 3
Hi High (pH 8-9.5) 1.24 1.76 -2.77 2 2 0 32 165.236 3

Vendor Notes

Note Type Comments Provided By
Molecular_Solubility 3.414 Bitter DB
ALOGPS_SOLUBILITY 8.26e+00 g/l DrugBank-approved
Therapy bronchodilator, decongestant SMDC Pharmakon
Therapy decongestant SMDC Iconix
Patent Database Links EP1099438; EP1136071; EP1215201; EP1229034; EP1498114; EP1570844; EP1614681; EP1621532; EP1674078; EP1674084; EP1685843; EP1714641; EP1759711; EP1880717; EP1990639; GB2361473; US2002128247; US2003114392; US2003176717; US2004077021; US2004241816; US2004261 ChEBI
Patent Database Links EP1676557; EP1913937; WO2007112747 ChEBI
H phrase H319: Causes serious eye irritation; H315: Causes skin irritation; H335: May cause respiratory irritation; H302: Harmful if swallowed Acros Organics
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye Acros Organics
R phrase R22: Harmful if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin. Acros Organics
S phrase S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection. Acros Organics
Hazard XN: Harmful Acros Organics

Activity (Go SEA)

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