Structure #1
  Mrv0541 02241212482D          

 16 18  0  0  0  0            999 V2000
   -0.7145    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0366    4.7045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4491    3.9900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2296    4.5330    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8971    3.3769    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  4  1  0  0  0  0
  2  7  1  0  0  0  0
  3  5  2  0  0  0  0
  3  6  1  0  0  0  0
  4 11  2  0  0  0  0
  5 11  1  0  0  0  0
  6 12  2  0  0  0  0
  7 13  2  0  0  0  0
  8  9  1  0  0  0  0
  8 15  1  0  0  0  0
  9 16  1  0  0  0  0
 10 12  1  0  0  0  0
 10 14  1  0  0  0  0
 11 13  1  0  0  0  0
 12 13  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
M  END
> <DATABASE_ID>
DB06711

> <DATABASE_NAME>
drugbank

> <SMILES>
C(C1=NCCN1)C1=CC=CC2=CC=CC=C12

> <INCHI_IDENTIFIER>
InChI=1S/C14H14N2/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14/h1-7H,8-10H2,(H,15,16)

> <INCHI_KEY>
CNIIGCLFLJGOGP-UHFFFAOYSA-N

> <FORMULA>
C14H14N2

> <MOLECULAR_WEIGHT>
210.2744

> <EXACT_MASS>
210.115698458

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_ATOM_COUNT>
30

> <JCHEM_AVERAGE_NEUTRAL_MICROSPECIES_CHARGE>
0.9993561369898548

> <JCHEM_AVERAGE_POLARIZABILITY>
23.77365520681211

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
2-[(naphthalen-1-yl)methyl]-4,5-dihydro-1H-imidazole

> <ALOGPS_LOGP>
3.44

> <JCHEM_LOGP>
2.1931169496666665

> <ALOGPS_LOGS>
-3.74

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NEUTRAL_CHARGE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA_STRONGEST_BASIC>
10.190926808201356

> <JCHEM_POLAR_SURFACE_AREA>
24.39

> <JCHEM_REFRACTIVITY>
65.51950000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
3.81e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
biotin

> <JCHEM_VEBER_RULE>
1

> <DRUGBANK_ID>
DB06711

> <DRUG_GROUPS>
approved; investigational

> <GENERIC_NAME>
Naphazoline

> <SYNONYMS>
Nafazolin; Nafazolina; Naphazoline

> <PRODUCTS>
7 Select Redness Relief; AK-Con; Advanced Eye Relief/ Redness Instant Relief; Advanced Eye Relief/ Redness Maximum Relief; Albalon; Albalon A; Allergy Eye Drops; Blue Collyrium; CVS Maximum Redness Relief; CareOne Maximum Redness Relief Eye Drops; CareOne Maximum Strength Redness Relief; Clear Eyes; Clear Eyes Acr By Murine; Clear Eyes Allergy; Clear Eyes By Murine Eye Dps; Clear Eyes Complete 7 Symptom Relief; Clear Eyes Complete 7 Sympton Relief; Clear Eyes Cooling Itchy Eye Relief; Clear Eyes Cooling Redness Relief; Clear Eyes Extra Strength Redness Relief; Clear Eyes Maximum Itchy Eye Relief; Clear Eyes Maximum Itchy Eye Relief Handy Pocket Pal; Clear Eyes Maximum Redness Relief; Clear Eyes Redness Relief; Clear Eyes Redness Relief Eye Drops Sterile; Clear Eyes Redness Relief Handy Pocket Pal; Clear Eyes for Dry Eyes Plus Redness Relief; Cleareyes Maximum Itchy Eye Relief; Cleareyes Redness Relief; Collyre Bleu; Collyre Bleu Laiter; Cooper A.R.; DG Maximum Strength Redness Relief; Dg Health Maximum Redness Relief; Diopticon A Liq; Diopticon Liq 0.1%; Equate Eye Allergy Relief Drops; Equate Redness and Dry Eye Relief Eye Drops; Eye Allergy Relief; Eye Drops Redness and Dry Eye Relief; Eyellic Eye Drops (Sterile); Family Care Redness Relief; Family Wellness Maximum Redness Relief Eye Drops; First Aid Direct Industrial Eye Drops; Floril Redness Relief; Foster and Thrive Redness Relief Eye Drops; GNP Eye Drops Redness and Dry Eye Relief; GNP EyeDrops Maximum Redness Relief; Good Neighbor Pharmacy Redness Relief; GoodSense Redness Relief Plus; Goodsense Maximum Strength Redness Relief Plus; HEB Eye Drops; Harris Teeter Eye Drops Maximum Redness Relief; Health Mart Redness Relief; Hi-Drops; Hyd; Leader Eye Drops Redness Relief; Lidl Redness Relief; Lubricant / Redness Reliever; Lubricant and Redness Reliever; Maximum Redness Relief Eye; Medics Choice Eye Drops Maximum Redness Relief; Meijer Maximum Redness Relief and Lubricant; Meijer Redness Relief; Nafasolina; Naphazoline; Naphazoline HCI And Pheniramine Maleate; Naphazoline Hydrochloride; Naphazoline Hydrochloride and Pheniramine Maleate; Naphcon; Naphcon A; Naphcon Forte; Nazal; Nazil Ofteno; Odan-naphazoline; Opcon Oph Soln 0.1%; Opcon-A; Opti-tears Allergy; Opti-tears Red Eye; Optic Splash; Optrex Plus Decongestant Eye Drops; Original Redness Reliever; Pi Yen Chin; Pi Yuan Chin; Privine; Pure Eyes Sterile Eyes; R.O.-naphz; Reactine Eye Drops; Red Away; Red Eye Relief; Redness Eye Drops; Refresh Eye Allergy Relief; Refresh Redness Relief; Revitalize Energizing Eye Drops; Rhino Mex; Rohto Beauty Secret; Rohto Cool; Rohto Cool Max; Rohto Cool Relief; Rohto Max Strength; Rohto Optic Glow; SK Maximum Redness Relief; Sato Clear; Signature Care Eye Drops Redness and Dry Eye Relief; Soothe Allergy; Soothe Redness; Splash Redness Reliever; Steritears Ar; Sunmark Redness Relief; Target Eye Drops Maximum Redness Relief Eye; Topcare Maximum Redness Relief Eye Drops; Vasocon; Vasocon A Eye Drops; Vasocon A Oph Soln; Vasocon Eye Drops; Vasocon Oph Soln 0.1%; Visine A Multi-Action Eye Allergy Relief; Visine Allergy Eye Relief Multi-Action; Visine for Allergy With Antihistamine; Walgreens Eye Drops Maximum Redness Relief 15mL; Walgreens Maximum Redness Relief; Walgreens Redness Relief Eye Drops 15mL; Xpect Industrial Eye Relief; Zincfrin A; i-Drops ARTIFICIAL TEARS; i-Drops DECONGESTANT EYE DROPS

> <SALTS>
Naphazoline hydrochloride; Naphazoline nitrate

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