UCSF

ZINC03872317

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2005 25 Yes

Popular Name: Dipivefrin Dipivefrin

Find On: PubMed — Wikipedia — Google

CAS Numbers: 52365-63-6 , 64019-93-8 , [64019-93-8]

Other Names:

( -)-2,2-Dimethylpropansaeure-4-(1-hydroxy-2-(methylamino)ethyl)-1,2-phenylenester

( -)-4-(1-Hydroxy-2-methylaminoethyl)-o-phenylendipivalat

(+-)-3,4-Dihydroxy-alpha-((methylamino)methyl)benzyl alcohol 3,4-dipivalate

(+-)-3,4-Dihydroxy-alpha-((methylamino)methyl)benzyl alcohol 3,4-dipivalate hydrochloride; (1)-4-(1-Hydroxy-2-(methylamino)ethyl)-1,2-phenylene dipivalate hydrochloride; AKPRO; C19H29NO5.HCl; DIPIVEFRIN HCL; DIPIVEFRIN HYDROCHLORIDE; Dipivalyl epinephrine

(+-)-4-[1-hydroxy-2-(methylamino)ethyl]-o-phenylene divavalate

(+-)-4-[1-hydroxy-2-(methylamino)ethyl]-o-phenylene divavalate; 1-(3',4'-dipivaloyloxyphenyl)-2-methylamino-1-ethanol; 4-[1-hydroxy-2-(methylamino)ethyl]-o-phenylene divavalate; Dipivefrin; Dipivefrine; dipivalyl epinephrine

(RS)-4-(1-Hydroxy-2-(methylamino)ethyl)-1,2-phenylen dipivalat

1-(3',4'-dipivaloyloxyphenyl)-2-methylamino-1-ethanol

2,2-Dimethylpropanoic acid 4-[1-hydroxy-2-(methylamino)ethyl]-1,2-phenylene ester

4-(1-Hydroxy-2-(methylamino)ethyl)-1,2-phenylen dipivalat

4-[1-hydroxy-2-(methylamino)ethyl]-o-phenylene divavalate

4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diyl bis(2,2-dimethylpropanoate)

52365-63-6

52365-63-6; C06963; Dipivefrin; Dipivefrine

52365-63-6; D02349; Dipivefrin (USAN); Dipivefrine (INN)

AB00514686

AC1L1F6K

AKOS003662293

AKPro

BPBio1_000688

BRD-A47494775-003-03-0

BSPBio_000624

C06963

C19H29NO5

CHEBI:4646

CID3105

D02349

DAP000593

DB00449

dipivalyl epinephrine

Dipivefrin (USAN)

Dipivefrin (USAN); Dipivefrine (BAN

Dipivefrin HCL

Dipivefrin hydrochloride

Dipivefrin [USAN]

dipivefrin(1+)

Dipivefrina

Dipivefrina [INN-Spanish]

dipivefrina; dipivefrine; dipivefrinum

Dipivefrine

Dipivefrine (INN)

Dipivefrinum

Dipivefrinum [INN-Latin]

DPE

FDA

INN); Dipivefrin HCl (FDA

INN); Dipivefrin Hydrochloride (JAN

JAN

JAN)

K 30081

L000915

LS-121419

MFCD00673243

MFCD01697462

NCGC00179499-01

nchembio747-comp3

Ophtho-Dipivefrin

Prestwick0_000632

Prestwick1_000632

Prestwick2_000632

Prestwick3_000632

Propanoic acid, 2,2-dimethyl-, 4-(1-hydroxy-2-(methylamino)ethyl)-1,2-phenylene ester, (+-)-

Propine

Propine C Cap B.I.D.

SPBio_002843

UNII-8Q1PVL543G

USP

USP)

[2-(2,2-dimethylpropanoyloxy)-4-[1-hydroxy-2-(methylamino)ethyl]phenyl] 2,2-dimethylpropanoate

Download: MOL2 SDF SMILES Flexibase

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) 2.53 8.7 -50.49 3 6 1 89 352.451 9 ↓
Hi High (pH 8-9.5) 2.53 7.27 -13.26 2 6 0 85 351.443 9 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 5.82e-02 g/l DrugBank-approved
PUBCHEM_PATENT_ID EP0105840A1; EP0126684A2; EP0126684B1; EP0288659A1; EP0345028A2; EP0362321B1; EP0424042A1; EP0424042B1; EP0424043A1; EP0424043B1; EP0432899A1; EP0437368B1; EP0533836B1; EP0536255A1; EP0536255B1; EP0537165A1; EP0537165B1; EP0550615B1; EP0590786B1; EP067695 IBM Patent Data

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