Mrv0541 02241204342D          

  6  4  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 Cu  0  2  0  0  0  0  0  0  0  0  0  0
    2.8286   -0.8250    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.8286    0.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.8286    0.8250    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.6536    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0036    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  2  0  0  0  0
  3  6  2  0  0  0  0
M  CHG  3   1   2   2  -1   4  -1
M  END
> <DATABASE_ID>
DB06778

> <DATABASE_NAME>
drugbank

> <SMILES>
[Cu++].[O-]S([O-])(=O)=O

> <INCHI_IDENTIFIER>
InChI=1S/Cu.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2

> <INCHI_KEY>
ARUVKPQLZAKDPS-UHFFFAOYSA-L

> <FORMULA>
CuO4S

> <MOLECULAR_WEIGHT>
159.609

> <EXACT_MASS>
158.881330257

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
6

> <JCHEM_AVERAGE_NEUTRAL_MICROSPECIES_CHARGE>
-1.9999960608374163

> <JCHEM_AVERAGE_POLARIZABILITY>
5.805278247285031

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
copper(2+) sulfate

> <ALOGPS_LOGP>
-0.12

> <JCHEM_LOGP>
-0.8415520233333333

> <ALOGPS_LOGS>
-0.67

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NEUTRAL_CHARGE>
-2

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-2

> <JCHEM_PKA>
1.8964254257138706

> <JCHEM_PKA_STRONGEST_ACIDIC>
-3.0343490541919906

> <JCHEM_POLAR_SURFACE_AREA>
80.25999999999999

> <JCHEM_REFRACTIVITY>
11.5274

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
4.57e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
tetrahydrofolic acid

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DB06778

> <DRUG_GROUPS>
approved

> <GENERIC_NAME>
Cupric sulfate

> <SYNONYMS>
Copper monosulfate; Copper monosulphate; Copper sulfate; Copper sulfate (1:1); Copper sulphate; Copper(2+) sulfate; Copper(II) sulphate; Cupric sulfate anhydrous; Cupric sulfate, anhydrous; Cupric sulphate anhydrous; Cupric sulphate, anhydrous

> <PRODUCTS>
Active OB; Aquatec Alonglife; C-Nate DHA; Cavan Heme OB; Centratex; Concept DHA; Concept OB; Cupric Sulfate; Dexatran; Dothelle DHA; Dynamiclear Rapid; Earthpals Children's Chewables Multi-vitamin & Mineral Tablets; Eau Resolutive Soker; Efferlife Multivitamins and Minerals; Folivane-OB; Formula EC; Hematron-AF; Hemax; HemeNatal OB; HemeNatal OB plus DHA; Hemocyte Plus; High Potency Multivitamins & Minerals Caplets; Iron Plus Tab; M T E 4 Concentrate Inj; M.T.E.-4; M.T.E.-4 Concentrated; M.T.E.-6 Concentrated; Mega Min Capsules; Mega Vitaminerals; Micro Cu; Micro Plus 4 Concentrate; Micro Plus 4 Regular Strength; Micro Plus 5 Concentrate; Micro Plus 6 (concentrate); Micro Plus 6 (pediatric); Micro Plus 6 (regular); Micro+ Te Pediatric; Micro+6 Concentrate; Multiple Trace Metal Additive Solution; Multiple Vitamins & Minerals Tablets; Multiple Vitamins With Minerals Tablets; Multiple Vitamins and Minerals Capsules; Multitrace -4; Multitrace -4 Pediatric; Multitrace-4; Multitrace-4 Neonatal; Multitrace-5; Multivitamines Et Mineraux; Multivitamins W Minerals Extra Strength; Multivitamins and Minerals Tablets; Multrys; Nano - Q1; OB Complete 400; OB Complete DHA; OB Complete Petite; One A Day Advance Adults; One A Day Advance Adults 50+; One-A-day Advance Men's; Paire OB Plus DHA; Phytopure; Pnv-VP-U; Prefera OB plus DHA; PreferaOB; PreferaOB plus DHA; Prenatal Vitamin and Mineral Supplement Tab; Provida DHA; PureFe OB Plus; PureFe Plus; PureVit DualFe Plus; Quflora Pediatric; Quflora Pediatric Drops; RE FAC-x; Relnate DHA; Se-Plete DHA; Se-Tan PLUS; Spd Tab; Spectrum Performa Multivitamins and Minerals Tablets; Stress B Complex With C,e, Zinc and Copper; Stress Tab With Zinc, Copper and Vitamin E; Strovite One Caplets; TL-Care DHA; Tandem OB; Tandem Plus; Taron-C DHA; Tl-hem 150; Totalvit Plus; Trace Elements 4; Tralement; Tricare Prenatal; Tricare Prenatal Compleat; Tricare Prenatal DHA One; Tricare Prenatal DHA One Rx Multivitamin; Tricare Prenatal DHA One With Folate; Ultimate OB DHA; Viprot; Virt-C DHA; Virt-Nate DHA; Vitamines Et Mineraux; Vitamines Et Mineraux Comprimes; Vitamines Et Mineraux Enfants 970; Vitogen B Stress C Vit E Zinc & Cop; Viva CT Prenatal; Vp-heme Ob; Vp-heme Ob DHA; Vp-pnv-dha; WesCap-C-DHA; WesNate DHA

> <INTERNATIONAL_BRANDS>
Gynoseptyl; Gynostad; Hi Trace Copper; Intense Copper; M-Care; Zyload

> <SALTS>
Cupric sulfate pentahydrate

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