Drug Information

Drug ID:  NPD6075
Drug Name:  Glimepiride
Molecular Formula:  C24H34N4O5S
Canonical SMILES:  CCC1=C(C)CN(C1=O)C(=NCCc1ccc(cc1)S(=O)(=O)NC(=NC1CCC(CC1)C)O)O
Standard InCHI:  InChI=1S/C24H34N4O5S/c1-4-21-17(3)15-28(22(21)29)24(31)25-14-13-18-7-11-20(12-8-18)34(32,33)27-23(30)26-19-9-5-16(2)6-10-19/h7-8,11-12,16,19H,4-6,9-10,13-15H2,1-3H3,(H,25,31)(H2,26,27,30)
Standard InCHIKey:  WIGIZIANZCJQQY-UHFFFAOYSA-N
Max Developmental Stage:  Approved
Max Developmental Stage Source:  TTD; DrugBank

  Structural Similarity Between NPASS Natural Products and NPD6075

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.


  Similar Natural Products

High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7

Similarity Level Similarity Score Natural Product ID
High Similarity 1.0 NPC32858
High Similarity 1.0 NPC194857
Intermediate Similarity 0.7236 NPC317400
Remote Similarity 0.6861 NPC470544
Remote Similarity 0.6846 NPC132636
Remote Similarity 0.6812 NPC470545
Remote Similarity 0.6763 NPC470546
Remote Similarity 0.6739 NPC239357
Remote Similarity 0.6713 NPC22746
Remote Similarity 0.6642 NPC476048
Remote Similarity 0.6621 NPC477937
Remote Similarity 0.662 NPC71684
Remote Similarity 0.6617 NPC471447
Remote Similarity 0.6571 NPC476440
Remote Similarity 0.6562 NPC471319
Remote Similarity 0.6562 NPC471320
Remote Similarity 0.6549 NPC200964
Remote Similarity 0.6541 NPC143516
Remote Similarity 0.6496 NPC181390
Remote Similarity 0.6496 NPC475013
Remote Similarity 0.6493 NPC474973
Remote Similarity 0.6493 NPC45033
Remote Similarity 0.6493 NPC130898
Remote Similarity 0.6493 NPC474804
Remote Similarity 0.6486 NPC300315
Remote Similarity 0.6475 NPC33742
Remote Similarity 0.6457 NPC473661
Remote Similarity 0.6454 NPC254088
Remote Similarity 0.6439 NPC329375
Remote Similarity 0.6438 NPC101719
Remote Similarity 0.6433 NPC313850
Remote Similarity 0.6419 NPC111428
Remote Similarity 0.6419 NPC473322
Remote Similarity 0.6418 NPC473418
Remote Similarity 0.6414 NPC6975
Remote Similarity 0.6405 NPC89489
Remote Similarity 0.6403 NPC35850
Remote Similarity 0.6403 NPC276949
Remote Similarity 0.64 NPC325479
Remote Similarity 0.6389 NPC202521
Remote Similarity 0.6376 NPC200589
Remote Similarity 0.637 NPC222466
Remote Similarity 0.6357 NPC108339
Remote Similarity 0.6357 NPC246904
Remote Similarity 0.6333 NPC255447
Remote Similarity 0.6319 NPC476990
Remote Similarity 0.6319 NPC27833
Remote Similarity 0.6306 NPC322878
Remote Similarity 0.6294 NPC220698
Remote Similarity 0.6277 NPC473676
Remote Similarity 0.6235 NPC286551
Remote Similarity 0.6233 NPC252878
Remote Similarity 0.6231 NPC256452
Remote Similarity 0.6225 NPC126458
Remote Similarity 0.6222 NPC275467
Remote Similarity 0.6216 NPC79698
Remote Similarity 0.6197 NPC473573
Remote Similarity 0.619 NPC305602
Remote Similarity 0.619 NPC17497
Remote Similarity 0.619 NPC46427
Remote Similarity 0.6154 NPC315276
Remote Similarity 0.6154 NPC285926
Remote Similarity 0.6154 NPC14672
Remote Similarity 0.6136 NPC472258
Remote Similarity 0.6133 NPC319766
Remote Similarity 0.6125 NPC311658
Remote Similarity 0.6118 NPC130309
Remote Similarity 0.6108 NPC469243
Remote Similarity 0.6104 NPC141050
Remote Similarity 0.6103 NPC469974
Remote Similarity 0.6099 NPC474584
Remote Similarity 0.6093 NPC165726
Remote Similarity 0.6093 NPC213969
Remote Similarity 0.6076 NPC468984
Remote Similarity 0.6065 NPC314835
Remote Similarity 0.6061 NPC25565
Remote Similarity 0.6049 NPC283783
Remote Similarity 0.6039 NPC287401
Remote Similarity 0.6031 NPC71140
Remote Similarity 0.6031 NPC474974
Remote Similarity 0.6015 NPC473501
Remote Similarity 0.6015 NPC475439
Remote Similarity 0.6014 NPC473498
Remote Similarity 0.6012 NPC475544
Remote Similarity 0.6012 NPC154478
Remote Similarity 0.6 NPC473002
Remote Similarity 0.6 NPC223207
Remote Similarity 0.5988 NPC84317
Remote Similarity 0.5988 NPC105717
Remote Similarity 0.5986 NPC302169
Remote Similarity 0.5975 NPC161069
Remote Similarity 0.5974 NPC473962
Remote Similarity 0.5965 NPC471771
Remote Similarity 0.5965 NPC290755
Remote Similarity 0.5965 NPC304074
Remote Similarity 0.5964 NPC473580
Remote Similarity 0.5964 NPC469903
Remote Similarity 0.5963 NPC314114
Remote Similarity 0.5951 NPC13470
Remote Similarity 0.5942 NPC167336
Remote Similarity 0.5938 NPC52748
Remote Similarity 0.5924 NPC43755
Remote Similarity 0.5924 NPC471265
Remote Similarity 0.5924 NPC471264
Remote Similarity 0.5924 NPC127741
Remote Similarity 0.5912 NPC202613
Remote Similarity 0.5909 NPC120251
Remote Similarity 0.5909 NPC7067
Remote Similarity 0.5906 NPC217804
Remote Similarity 0.5906 NPC210377
Remote Similarity 0.5906 NPC22883
Remote Similarity 0.5906 NPC5719
Remote Similarity 0.5901 NPC315266
Remote Similarity 0.5901 NPC478040
Remote Similarity 0.5901 NPC209509
Remote Similarity 0.5899 NPC472999
Remote Similarity 0.5899 NPC327481
Remote Similarity 0.5897 NPC248283
Remote Similarity 0.5893 NPC324850
Remote Similarity 0.5886 NPC98424
Remote Similarity 0.5886 NPC92784
Remote Similarity 0.5886 NPC178662
Remote Similarity 0.5886 NPC470884
Remote Similarity 0.5886 NPC77992
Remote Similarity 0.5886 NPC476133
Remote Similarity 0.5882 NPC73655
Remote Similarity 0.5879 NPC300443
Remote Similarity 0.5873 NPC474088
Remote Similarity 0.5872 NPC15068
Remote Similarity 0.5867 NPC175726
Remote Similarity 0.5867 NPC474082
Remote Similarity 0.5864 NPC262077
Remote Similarity 0.5862 NPC198254
Remote Similarity 0.5862 NPC274198
Remote Similarity 0.5858 NPC62104
Remote Similarity 0.5858 NPC1390
Remote Similarity 0.5849 NPC239762
Remote Similarity 0.5849 NPC163392
Remote Similarity 0.5845 NPC319579
Remote Similarity 0.5843 NPC122590
Remote Similarity 0.5838 NPC63040
Remote Similarity 0.5828 NPC16188
Remote Similarity 0.5828 NPC138775
Remote Similarity 0.5824 NPC473003
Remote Similarity 0.5824 NPC469902
Remote Similarity 0.5823 NPC68865
Remote Similarity 0.5817 NPC105114
Remote Similarity 0.5817 NPC152850
Remote Similarity 0.5817 NPC71933
Remote Similarity 0.5817 NPC89923
Remote Similarity 0.5817 NPC239990
Remote Similarity 0.5813 NPC263493
Remote Similarity 0.5813 NPC476989
Remote Similarity 0.5813 NPC269398
Remote Similarity 0.581 NPC153554
Remote Similarity 0.5802 NPC201244
Remote Similarity 0.5802 NPC477217
Remote Similarity 0.5802 NPC471680
Remote Similarity 0.5796 NPC474473
Remote Similarity 0.5795 NPC475532
Remote Similarity 0.5793 NPC471820
Remote Similarity 0.5793 NPC471821
Remote Similarity 0.5779 NPC313722
Remote Similarity 0.5779 NPC469666
Remote Similarity 0.5776 NPC77905
Remote Similarity 0.5771 NPC276506
Remote Similarity 0.5769 NPC207428
Remote Similarity 0.5765 NPC24617
Remote Similarity 0.5763 NPC165285
Remote Similarity 0.5759 NPC473360
Remote Similarity 0.5758 NPC254798
Remote Similarity 0.5758 NPC2501
Remote Similarity 0.5755 NPC194390
Remote Similarity 0.5755 NPC224610
Remote Similarity 0.5755 NPC88267
Remote Similarity 0.5755 NPC113326
Remote Similarity 0.5752 NPC136453
Remote Similarity 0.575 NPC307357
Remote Similarity 0.575 NPC476259
Remote Similarity 0.575 NPC268841
Remote Similarity 0.575 NPC46098
Remote Similarity 0.5746 NPC161972
Remote Similarity 0.5746 NPC303045
Remote Similarity 0.5745 NPC55529
Remote Similarity 0.5741 NPC476978
Remote Similarity 0.5732 NPC135121
Remote Similarity 0.5731 NPC114806
Remote Similarity 0.5731 NPC471527
Remote Similarity 0.573 NPC196243
Remote Similarity 0.5723 NPC475168
Remote Similarity 0.5723 NPC7817
Remote Similarity 0.5723 NPC189116
Remote Similarity 0.5714 NPC168113
Remote Similarity 0.5714 NPC129486
Remote Similarity 0.5714 NPC469427
Remote Similarity 0.5714 NPC469426
Remote Similarity 0.5714 NPC280022
Remote Similarity 0.5714 NPC231986
Remote Similarity 0.5706 NPC313867
Remote Similarity 0.5706 NPC5620

Drug Structure

External Identifiers

TTD   DAP000132
DrugBank   DB00222
ChEMBL   CHEMBL1481
IUPHAR/BPS  
PharmaGKB   PA449761
KEGG Drug   D00593
PubChem CID   3476
ChEBI   5383
CAS Number  93479-97-1

Drug Properties

Molecular Weight  490.22
ALogP  0.2885
MLogP  3
XLogP  4.487
HDA  9
HBD  3
Rotatable Bonds  14
TPSA  140.04
RO5 Violation  0