Mrv0541 05061304492D          

 10 12  0  0  0  0            999 V2000
    0.1163   -2.0322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8517   -0.9111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5873   -2.0322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5657   -0.4945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3012   -1.6156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0368   -0.4945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8517   -1.6585    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5657   -1.2419    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3012   -0.1208    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0368   -1.2419    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  7  1  1  0  0  0  0
 10  5  1  0  0  0  0
  7  3  1  0  0  0  0
  8  1  1  0  0  0  0
 10  3  1  0  0  0  0
  8  5  1  0  0  0  0
  9  2  1  0  0  0  0
  9  4  1  0  0  0  0
  9  6  1  0  0  0  0
  8  4  1  0  0  0  0
  7  2  1  0  0  0  0
 10  6  1  0  0  0  0
M  END
> <DATABASE_ID>
DB06799

> <DATABASE_NAME>
drugbank

> <SMILES>
C1N2CN3CN1CN(C2)C3

> <INCHI_IDENTIFIER>
InChI=1S/C6H12N4/c1-7-2-9-4-8(1)5-10(3-7)6-9/h1-6H2

> <INCHI_KEY>
VKYKSIONXSXAKP-UHFFFAOYSA-N

> <FORMULA>
C6H12N4

> <MOLECULAR_WEIGHT>
140.1863

> <EXACT_MASS>
140.106196404

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
22

> <JCHEM_AVERAGE_NEUTRAL_MICROSPECIES_CHARGE>
0.07111169955478021

> <JCHEM_AVERAGE_POLARIZABILITY>
14.252881306614109

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
1,3,5,7-tetraazatricyclo[3.3.1.1^{3,7}]decane

> <ALOGPS_LOGP>
-1.39

> <JCHEM_LOGP>
0.39213385666666695

> <ALOGPS_LOGS>
0.74

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NEUTRAL_CHARGE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
5.87696536708769

> <JCHEM_POLAR_SURFACE_AREA>
12.96

> <JCHEM_REFRACTIVITY>
36.995400000000004

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
7.66e+02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
tetrahydrofolic acid

> <JCHEM_VEBER_RULE>
1

> <DRUGBANK_ID>
DB06799

> <SECONDARY_ACCESSION_NUMBERS>
DB06146

> <DRUG_GROUPS>
approved; vet_approved

> <GENERIC_NAME>
Methenamine

> <SYNONYMS>
1,3,5,7-tetraazatricyclo[3.3.1.13,7]decane; Hexamethylenamine; Hexamethylene tetramine; Hexamethylenetetramine; Hexamethylentetramin; Hexamethylentetraminum; Hexamine; Hexaminum; HMT; HMTA; metenamina; méthénamine; Methenamine; methenaminum

> <PRODUCTS>
Air Disinfectant; All-In-One UTI Emergency Kit; Azo Urinary Tract Defense Antibacterial Protection; Azuphen Mb; CVS Antibacterial Plus Urinary Pain Relief; Cleaning Disinfectant; Cystex; Cystex Plus; Darcalma; Darpaz; Disinfectant(Model III)Sanitizer Hand And Surface; Good Neighbor Antibacterial Plus Urinary Pain Relief; Hip Rex Tab 1gm; Hiprex; Hyolev Mb; Hyophen; Indiomin Mb; Mandelamine; Me NaPhos MB Hyo 1; Meijer Antibacterial Plus Urinary Pain Relief; Methenamine Hippurate; Methenamine Mandelate; Methenamine and Sodium Salicylate; Methenamine and Sodium Salicylate (nsaid); Methylphen; Non Toxic Disinfectant; Phosenamine; Phosphasal; Preferred Antibacterial Plus Urinary Pain Relief; Premier Value Antibacterial Plus Urinary Pain Relief; Prosed/DS; Quality Choice Antibacterial Plus Urinary Pain Relief; Rite Aid Antibacterial Plus Urinary Pain Relief; Sanitizer; Saprolex Tab; TopCare Antibacterial Plus Urinary Pain Relief; UR N-C Urinary Antiseptic; URO-PAIN Dual Action Antibacterial Protection; Uqora Antibacterial Plus Urinary Pain Relief; UrNeva; Uralgic; Uramit Mb; Urasal Granules; Urelle; Uretron D/S; Uribel; Uribel Tabs; Urimar-T; Urimar-T Caps; Urin D/S; Urised; Uro-458; Uro-BLUE; Uro-L; Uro-MP; Uro-SP; UroAv-81; UroAv-B; Urogesic Blue; Urolet Mb; Urophen Mb; Ustell; Uta; Utac; Utira-C; Vilamit MB; Vilevev MB; Walgreens Antibacterial Plus Urinary Pain Relief; Youjie Weishi Air Disinfectant; Youjie Weishi Cloth Cleaning Disinfectant; Youjie Weishi Disinfectant; Youjie Weishi Kitchen Cleaning Disinfectant; Youjie Weishi Rinse-free Hand Disinfectant

> <SALTS>
Methenamine citrate; Methenamine diphosphate; Methenamine hippurate; Methenamine hydrochloride; Methenamine mandelate; Methenamine phosphate; Methenamine sulfate

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