634
  Mrv0541 02231214502D          

 14 14  0  0  0  0            999 V2000
    2.4751    0.7466    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500    0.7466    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3001    0.7466    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9041    1.5717    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4751    1.5717    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4751   -2.5534    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4751   -0.0784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7606   -0.4909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1895   -0.4909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4751   -1.7284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7606   -1.3159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1895   -1.3159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1895    1.9842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1895    2.8092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
  1  7  1  0  0  0  0
  4 13  2  0  0  0  0
  5 13  1  0  0  0  0
  6 10  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  2  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 13 14  1  0  0  0  0
M  END
> <DRUGBANK_ID>
DB00634

> <DRUG_GROUPS>
approved

> <GENERIC_NAME>
Sulfacetamide

> <SYNONYMS>
Acetosulfamine; N-Acetylsulfanilamide; N-Sulfanilylacetamide; N-Sulphanilylacetamide; N'-Acetylsulfanilamide; p-Aminobenzenesulfonacetamide; Sulphacetamide

> <BRANDS>
Albamine; Albucid; Alesten; Bleph-10; I-Sulfacet; Klaron; Oclucid; Ocusulf-10; Op-Sulfa 30; Ophthacet; Ophthel-S; Ovace; Region; Sebizon; Steramide; Sulamyd; Sulf-10; Sulf-15; Sulfacel-15; Sulfacet; Sulfair; Sulfair Forte; Sulfex; Sulphasil; Sulten-10; Sultrin

> <CHEMICAL_FORMULA>
C8H10N2O3S

> <MOLECULAR_WEIGHT>
214.242

> <EXACT_MASS>
214.041212886

> <IUPAC_NAME>
N-[(4-aminobenzene)sulfonyl]acetamide

> <INCHI_IDENTIFIER>
InChI=1S/C8H10N2O3S/c1-6(11)10-14(12,13)8-4-2-7(9)3-5-8/h2-5H,9H2,1H3,(H,10,11)

> <INCHI_KEY>
InChIKey=SKIVFJLNDNKQPD-UHFFFAOYSA-N

> <SMILES>
CC(=O)NS(=O)(=O)C1=CC=C(N)C=C1

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_DONOR_COUNT>
2

> <ALOGPS_LOGP>
0.15

> <JCHEM_LOGP>
-0.26

> <ALOGPS_LOGS>
-1.7

> <JCHEM_POLARIZABILITY>
20.49

> <JCHEM_POLAR_SURFACE_AREA>
89.26

> <JCHEM_REFRACTIVITY>
52.48

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <ALOGPS_SOLUBILITY>
4.21e+00 g/l

$$$$