UCSF

ZINC01530932

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 25 No

Popular Name: Methantheline Methantheline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 53-46-3 , 5818-17-7 , 63957-56-2

Other Names:

314

53-46-3; Banthine (TN); D00721; Methantheline bromide; Methanthelinium bromide (INN)

5818-17-7; C07849; Methantheline

AB00514028

AC1L1HEM

AC1Q65RT

Ammonium, diethyl(2-hydroxyethyl)methyl-, bromide, xanthene-9-carboxylate; Asabaine; Avagal; BANTHINE; Banthin; Bromure de methanthelinum [INN-French]; Bromuro de metantelinio [INN-Spanish]; C21H26NO3; Diethyl(2-hydroxyethyl)methylammonium bromide xanthen

Ammonium, diethyl(2-hydroxyethyl)methyl-, chloride, xanthene-9-carboxylate; Banthine chloride; LS-17439

AR-1J4187

Asabaine

Avagal

BAN

Banthin

Banthine

Banthine Bromide

Banthine Bromide;Methantheline Bromide;Methanthelinium;Methanthelinium Bromide;Methanthelinum;Methanthine Bromide;MTB 51

BPBio1_001158

BRD-K09859624-004-03-9

BSPBio_001052

C07849

CAS-53-46-3

CID4097

DAP001109

DB00940

DCF

diethyl-methyl-[2-(9H-xanthene-9-carbonyloxy)ethyl]azanium

diethyl-methyl-[2-(9H-xanthene-9-carbonyloxy)ethyl]azanium bromide

diethyl-methyl-[2-(9H-xanthene-9-carbonyloxy)ethyl]azaniumchloride

Dixamone Bromide

Doladene

Ethanaminium, N,N-diethyl-N-methyl-2-((9H-xanthen-9-ylcarbonyl)oxy)-

Frenogastrico

Gastric mucin

Gastrin I

Gastrin-1 Human

Gastron

Gastrosedan

INN)

L000712

Mantheline

Metantyl

Metaxan

Methanide

Methantheline bromide

Methantheline Bromide (FDA

Methanthelinium

Methanthelinium Bromide

Methanthelinum

Methanthine Bromide

Methelina

MFCD00031733

MTB 51

N,N-Diethyl-N-methyl-2-[(9H-xanthen-9-ylcarbonyl)oxy]ethanaminium

NCGC00016239-01

nchembio747-comp13

Prestwick0_001066

Prestwick1_001066

Prestwick2_001066

Prestwick3_001066

Resobantin

SPBio_002966

Ulcine

Ulcudexter

USP); Methanthelinium Bromide (BAN

USP); Methanthelinium Bromide (DCF

Vagamin

Vagantin

Xanteline

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) 0.06 13.28 -38.9 0 4 1 36 340.443 7 ↓

Vendor Notes

Note Type Comments Provided By
Molecular_Solubility 5.57 Bitter DB
ALOGPS_SOLUBILITY 1.32e-04 g/l DrugBank-approved

Activity (Go SEA)

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