Mrv1652306031607532D          

 24 23  0  0  0  0            999 V2000
    1.9520   -3.1599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2539   -2.0329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250   -2.8579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1270    3.9849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2539    3.6829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    2.8579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2539   -1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250   -0.6039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2539    1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    2.2539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2539    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1105    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6039    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3184    0.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1270   -1.7309    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9520    2.5559    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9520   -0.3020    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1270    1.1270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5395   -2.4454    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
    1.5395    3.2704    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
    1.5395   -1.0164    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
    1.5395    1.8414    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
    1.5395    0.4125    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
 13 12  1  0  0  0  0
 14 12  1  0  0  0  0
 15 13  1  0  0  0  0
 20  1  1  0  0  0  0
 20  2  1  0  0  0  0
 20  3  1  0  0  0  0
 20 16  1  0  0  0  0
 21  4  1  0  0  0  0
 21  5  1  0  0  0  0
 21  6  1  0  0  0  0
 21 17  1  0  0  0  0
 22  7  1  0  0  0  0
 22  8  1  0  0  0  0
 22 16  1  0  0  0  0
 22 18  1  0  0  0  0
 23  9  1  0  0  0  0
 23 10  1  0  0  0  0
 23 17  1  0  0  0  0
 23 19  1  0  0  0  0
 24 11  1  0  0  0  0
 24 14  1  0  0  0  0
 24 18  1  0  0  0  0
 24 19  1  0  0  0  0
M  END
> <DATABASE_ID>
CHEM044220

> <DATABASE_NAME>
chemdb

> <SMILES>
C[Si](C)(C)O[Si](C)(C)O[Si](C)(CCCN)O[Si](C)(C)O[Si](C)(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C14H41NO4Si5/c1-20(2,3)16-22(7,8)18-24(11,14-12-13-15)19-23(9,10)17-21(4,5)6/h12-15H2,1-11H3

> <INCHI_KEY>
PXUXLBITYUZGOV-UHFFFAOYSA-N

> <FORMULA>
C14H41NO4Si5

> <MOLECULAR_WEIGHT>
427.91

> <EXACT_MASS>
427.188191479

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_ATOM_COUNT>
65

> <JCHEM_AVERAGE_POLARIZABILITY>
44.4577985614185

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
6-(3-aminopropyl)-2,2,4,4,6,8,8,10,10-nonamethyl-3,5,7,9-tetraoxa-2,4,6,8,10-pentasilaundecane

> <ALOGPS_LOGP>
4.77

> <JCHEM_LOGP>
2.928700000000002

> <ALOGPS_LOGS>
-5.77

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA_STRONGEST_BASIC>
10.210180014646989

> <JCHEM_POLAR_SURFACE_AREA>
62.94000000000001

> <JCHEM_REFRACTIVITY>
88.48780000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
11

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
7.27e-04 g/l

> <JCHEM_TRADITIONAL_IUPAC>
6-(3-aminopropyl)-2,2,4,4,6,8,8,10,10-nonamethyl-3,5,7,9-tetraoxa-2,4,6,8,10-pentasilaundecane

> <JCHEM_VEBER_RULE>
0

> <NAME>
6-(3-aminopropyl)-2,2,4,4,6,8,8,10,10-nonamethyl-3,5,7,9-tetraoxa-2,4,6,8,10-pentasilaundecane

> <CAS>
99363-37-8

$$$$