UCSF

ZINC02019954

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2004 19 Yes

Other Names:

caine

2-Thiophenecarboxylic acid, 4-methyl-3-((1-oxo-2-(propylamino)propyl)amino)-, methyl ester, monohydrochloride; 2-Thiophenecarboxylic acid, 4-methyl-3-(2-(propylamino)propionamido)-, methyl ester, monohydrochloride; 4-Methyl-3-(2-(propylamino)propionamido)

2-thiophenecarboxylic acid, 4-methyl-3-[[1-oxo-2-(propylamino)propyl]amino]-, methyl ester

2-thiophenecarboxylic acid, 4-methyl-3-[[1-oxo-2-(propylamino)propyl]amino]-, methyl ester, hydrochloride

2-thiophenecarboxylic acid, 4-methyl-3-[[1-oxo-2-(propylamino)propyl]amino]-, methyl ester, monohydrochloride

23964-58-1; Articaine (INN); Carticaine; D07468

4-Methyl-3-(2-(propylamino)propionamido)-2-thiophenecarboxylic acid methyl ester

4-Methyl-3-(2-(propylamino)propionamido)-2-thiophenecarboxylic acid, methyl ester; Articaina [INN-Spanish]; Articaine; Articaine [INN:BAN]; Articainum [INN-Latin]; C13H20N2O3S; Carticaine; Hoe 045; LS-174027; Methyl (4-methyl-3-(2-(propylamino)propionamid

40 045; HOE-045

Articaine

Articaine (BAN

Articaine (hydrochloride)

Articaine HCl

ARTICAINE HYDROCHLORIDE; EPINEPHRINE BITARTRATE; LS-187836; SEPTOCAINE

Articaine, 99%+

BRD-A70514680-003-03-9

Carticaine HCl

HOE-045

HOE-045; 40045

INN); Articaine HCl (FDA

INN); Articaine Hydrochloride (FDA

Methyl (4-methyl-3-(2-(propylamino)propionamido)-2-thiophencarboxylat)

Methyl 4-methyl-3-[(N-propylalanyl)amino]-2-thiophenecarboxylate hydrochloride

methyl 4-methyl-3-[(N-propylalanyl)amino]thiophene-2-carboxylate

methyl 4-methyl-3-[(N-propylalanyl)amino]thiophene-2-carboxylate hydrochloride

methyl4-methyl-3-[(n-propylalanyl)amino]-2-thiophenecarboxylatehydrochloride

METHYLMETHYLPROPYLALANYLAMINOTHIOPHENECARBOXYLATEHYDROCHLORID

MFCD00190157

MFCD00864454

N/A

QA-8075

USAN)

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) 2.15 5.48 -38.89 3 5 1 72 285.389 7
Hi High (pH 8-9.5) 2.15 4.23 -8.32 2 5 0 67 284.381 7

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific
Indications local anesthetic KeyOrganics Bioactives
Target Others Selleck Chemicals

Activity (Go SEA)

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

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