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Compound 134
  CheckMol                        TMF02:r0:m0
MF=C21H27N5O4S MW=445.54
 31 33  0  3  0               999 V2000
    0.0000   -0.0000   -0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7577   -1.2905   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7341   -1.2905   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3142    0.7577   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2905    0.7577   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6284    0.0237   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2787    2.2732   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5810    0.0237   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6402   -1.4681   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9426    0.7814   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5692    3.0309   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8715    0.7814   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2568    0.0355   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8597    2.2850   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -6.5710    0.7933   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2686   -1.4563   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1502    3.0428   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8852    0.0474   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5828   -2.2022   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4407    2.3087   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8970   -1.4444   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7313    3.0665   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.0218    2.3324   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0099    0.8406   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3123    3.0901   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   10.3004    4.6056   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
   11.6028    2.3442   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   11.5910    5.3633   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   12.8933    3.1138   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
   12.8815    4.6293   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   14.1720    5.3870   -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  4  1  0  0  0  0
  1  5  1  0  0  0  0
  4  6  1  0  0  0  0
  5  7 02  0  1  0  0
  5  8 01  0  1  0  0
  6  9  2  0  0  0  0
  6 10  1  0  0  0  0
  7 11 01  0  1  0  0
  8 12 02  0  1  0  0
 10 13  1  0  0  0  0
 11 14 02  0  1  0  0
 13 15  1  0  1  0  0
 13 16  1  0  1  0  0
 14 17  1  0  0  0  0
 15 18  1  0  1  0  0
 16 19  1  0  1  0  0
 17 20  1  0  0  0  0
 18 21  1  0  1  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 23 25  1  0  0  0  0
 25 26 02  0  1  0  0
 25 27 01  0  1  0  0
 26 28 01  0  1  0  0
 27 29 02  0  1  0  0
 28 30 02  0  1  0  0
 30 31  1  0  0  0  0
 12 14 01  0  1  0  0
 19 21  1  0  1  0  0
 29 30 01  0  1  0  0
M  END

Glipizide

₹ 0.00 0.00

Chemical Name - Glipizide
Mol Weight - 445.542
Smiles - Cc(nc1)cnc1C(NCCc(cc1)ccc1S(NC(NC1CCCCC1)=O)(=O)=O)=O

Property Name	Property Value
Mol Name	Glipizide
Molweight	445.542
Monoisotopic Mass	445.178375
Clogp	1.8635
Clogs	-3.446
H Acceptors	9
H Donors	3
Total Surface Area	336.58
Relative Psa	0.32973
Polar Surface Area	138.53
Druglikeness	3.385
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.67742
Molecular Flexibility	0.52891
Molecular Complexity	0.74882
Fragments	1
Non H Atoms	31
Non Ch Atoms	10
Electronegative Atoms	10
Rotatable Bonds	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3 Atoms	10
Symmetric Atoms	5
Amides	3
Aromatic Nitrogens	2
Smiles	Cc(nc1)cnc1C(NCCc(cc1)ccc1S(NC(NC1CCCCC1)=O)(=O)=O)=O
InChIKey	InChI=1S/C21H27N5O4S/c1-15-13-24-19(14-23-15)20(27)22-12-11-16-7-9-18(10-8-16)31(29,30)26-21(28)25-17-5-3-2-4-6-17/h7-10,13-14,17H,2-6,11-12H2,1H3,(H,22,27)(H2,25,26,28)
InChI	ZJJXGWJIGJFDTL-UHFFFAOYSA-N

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Glipizide