Drug Information

Drug ID:  NPD3663
Drug Name:  Glycopyrrolate
Molecular Formula:  C19H28NO3
Canonical SMILES:  O=C(C(c1ccccc1)(C1CCCC1)O)OC1CC[N+](C1)(C)C
Standard InCHI:  InChI=1S/C19H28NO3/c1-20(2)13-12-17(14-20)23-18(21)19(22,16-10-6-7-11-16)15-8-4-3-5-9-15/h3-5,8-9,16-17,22H,6-7,10-14H2,1-2H3/q+1
Standard InCHIKey:  ANGKOCUUWGHLCE-UHFFFAOYSA-N
Max Developmental Stage:  Approved
Max Developmental Stage Source:  TTD; ChEMBL; IUPHAR/BPS

  Structural Similarity Between NPASS Natural Products and NPD3663

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 0.874 NPC65310
Intermediate Similarity 0.8 NPC84281
Intermediate Similarity 0.8 NPC213126
Intermediate Similarity 0.8 NPC317474
Intermediate Similarity 0.8 NPC291027
Intermediate Similarity 0.8 NPC169485
Intermediate Similarity 0.7955 NPC474847
Intermediate Similarity 0.7852 NPC69496
Intermediate Similarity 0.781 NPC233910
Intermediate Similarity 0.781 NPC245836
Intermediate Similarity 0.7769 NPC160382
Intermediate Similarity 0.7698 NPC260045
Intermediate Similarity 0.7698 NPC476102
Intermediate Similarity 0.7698 NPC118099
Intermediate Similarity 0.7698 NPC49577
Intermediate Similarity 0.7698 NPC474855
Intermediate Similarity 0.7698 NPC474811
Intermediate Similarity 0.7698 NPC79465
Intermediate Similarity 0.7698 NPC475318
Intermediate Similarity 0.7698 NPC273907
Intermediate Similarity 0.7698 NPC474787
Intermediate Similarity 0.7698 NPC475598
Intermediate Similarity 0.7698 NPC293377
Intermediate Similarity 0.7698 NPC9687
Intermediate Similarity 0.7698 NPC76785
Intermediate Similarity 0.7698 NPC90194
Intermediate Similarity 0.7698 NPC151706
Intermediate Similarity 0.7463 NPC26285
Intermediate Similarity 0.7438 NPC175852
Intermediate Similarity 0.7438 NPC210529
Intermediate Similarity 0.7438 NPC160548
Intermediate Similarity 0.7431 NPC251439
Intermediate Similarity 0.7429 NPC313663
Intermediate Similarity 0.7383 NPC162104
Intermediate Similarity 0.7313 NPC190663
Intermediate Similarity 0.7313 NPC80150
Intermediate Similarity 0.7266 NPC213969
Intermediate Similarity 0.7266 NPC165726
Intermediate Similarity 0.7266 NPC158854
Intermediate Similarity 0.7259 NPC476281
Intermediate Similarity 0.7259 NPC476184
Intermediate Similarity 0.7241 NPC263493
Intermediate Similarity 0.7241 NPC269398
Intermediate Similarity 0.723 NPC145113
Intermediate Similarity 0.7226 NPC285394
Intermediate Similarity 0.7226 NPC471466
Intermediate Similarity 0.7222 NPC281104
Intermediate Similarity 0.7206 NPC160493
Intermediate Similarity 0.7192 NPC57976
Intermediate Similarity 0.7185 NPC476183
Intermediate Similarity 0.7153 NPC476278
Intermediate Similarity 0.7143 NPC472707
Intermediate Similarity 0.7143 NPC19136
Intermediate Similarity 0.7121 NPC469509
Intermediate Similarity 0.7114 NPC329761
Intermediate Similarity 0.7114 NPC225648
Intermediate Similarity 0.7101 NPC476260
Intermediate Similarity 0.7101 NPC476241
Intermediate Similarity 0.7068 NPC210531
Intermediate Similarity 0.705 NPC476179
Intermediate Similarity 0.705 NPC476125
Intermediate Similarity 0.704 NPC228400
Intermediate Similarity 0.704 NPC214200
Intermediate Similarity 0.7034 NPC471265
Intermediate Similarity 0.7034 NPC68865
Intermediate Similarity 0.7034 NPC471264
Intermediate Similarity 0.7029 NPC108286
Intermediate Similarity 0.7029 NPC469927
Intermediate Similarity 0.7027 NPC204546
Intermediate Similarity 0.7023 NPC269340
Intermediate Similarity 0.7 NPC65855
Intermediate Similarity 0.7 NPC292758
Remote Similarity 0.6986 NPC92784
Remote Similarity 0.6986 NPC178662
Remote Similarity 0.6986 NPC470884
Remote Similarity 0.6986 NPC98424
Remote Similarity 0.6986 NPC476133
Remote Similarity 0.6981 NPC469479
Remote Similarity 0.698 NPC209509
Remote Similarity 0.698 NPC5620
Remote Similarity 0.697 NPC48525
Remote Similarity 0.6944 NPC233692
Remote Similarity 0.6942 NPC317645
Remote Similarity 0.6929 NPC246166
Remote Similarity 0.6929 NPC477249
Remote Similarity 0.6929 NPC477248
Remote Similarity 0.6929 NPC4974
Remote Similarity 0.6928 NPC214239
Remote Similarity 0.6923 NPC197743
Remote Similarity 0.6923 NPC297145
Remote Similarity 0.6918 NPC109580
Remote Similarity 0.6918 NPC200154
Remote Similarity 0.6918 NPC313757
Remote Similarity 0.6918 NPC472247
Remote Similarity 0.6918 NPC6570
Remote Similarity 0.6918 NPC127741
Remote Similarity 0.6913 NPC476978
Remote Similarity 0.6912 NPC310467
Remote Similarity 0.6912 NPC237420
Remote Similarity 0.6905 NPC316797
Remote Similarity 0.6901 NPC296712
Remote Similarity 0.6894 NPC469505
Remote Similarity 0.6894 NPC158282
Remote Similarity 0.689 NPC129624
Remote Similarity 0.6889 NPC212891
Remote Similarity 0.6887 NPC135121
Remote Similarity 0.6861 NPC472708
Remote Similarity 0.6857 NPC14141
Remote Similarity 0.6857 NPC236981
Remote Similarity 0.6849 NPC311492
Remote Similarity 0.6849 NPC28836
Remote Similarity 0.6846 NPC139326
Remote Similarity 0.6846 NPC161069
Remote Similarity 0.6842 NPC471821
Remote Similarity 0.6842 NPC471820
Remote Similarity 0.6842 NPC240848
Remote Similarity 0.6838 NPC76308
Remote Similarity 0.6838 NPC169328
Remote Similarity 0.6838 NPC325295
Remote Similarity 0.6831 NPC239990
Remote Similarity 0.6831 NPC89923
Remote Similarity 0.6831 NPC71933
Remote Similarity 0.6831 NPC105114
Remote Similarity 0.6831 NPC152850
Remote Similarity 0.6829 NPC26108
Remote Similarity 0.6828 NPC233860
Remote Similarity 0.6828 NPC239358
Remote Similarity 0.6824 NPC307357
Remote Similarity 0.6824 NPC46098
Remote Similarity 0.6824 NPC268841
Remote Similarity 0.6822 NPC321670
Remote Similarity 0.6821 NPC262077
Remote Similarity 0.6818 NPC476003
Remote Similarity 0.6806 NPC272946
Remote Similarity 0.6797 NPC129666
Remote Similarity 0.6797 NPC476757
Remote Similarity 0.6794 NPC469511
Remote Similarity 0.6794 NPC281604
Remote Similarity 0.6794 NPC83628
Remote Similarity 0.6794 NPC265407
Remote Similarity 0.6794 NPC31274
Remote Similarity 0.6791 NPC307651
Remote Similarity 0.6791 NPC474363
Remote Similarity 0.6791 NPC153053
Remote Similarity 0.6783 NPC103605
Remote Similarity 0.6783 NPC81092
Remote Similarity 0.6781 NPC477680
Remote Similarity 0.6781 NPC472248
Remote Similarity 0.6776 NPC475578
Remote Similarity 0.6772 NPC469481
Remote Similarity 0.6769 NPC136962
Remote Similarity 0.6767 NPC474314
Remote Similarity 0.6763 NPC56634
Remote Similarity 0.6761 NPC136453
Remote Similarity 0.6761 NPC79608
Remote Similarity 0.6759 NPC45191
Remote Similarity 0.6755 NPC316008
Remote Similarity 0.6755 NPC477217
Remote Similarity 0.6755 NPC313867
Remote Similarity 0.6755 NPC201244
Remote Similarity 0.6755 NPC473922
Remote Similarity 0.675 NPC322387
Remote Similarity 0.6746 NPC322598
Remote Similarity 0.6742 NPC326187
Remote Similarity 0.6736 NPC478147
Remote Similarity 0.6728 NPC472115
Remote Similarity 0.6728 NPC472114
Remote Similarity 0.6721 NPC70940
Remote Similarity 0.6721 NPC86670
Remote Similarity 0.6721 NPC84288
Remote Similarity 0.6721 NPC274455
Remote Similarity 0.6719 NPC154905
Remote Similarity 0.6719 NPC60373
Remote Similarity 0.6719 NPC327226
Remote Similarity 0.6719 NPC304873
Remote Similarity 0.6718 NPC249811
Remote Similarity 0.6718 NPC156648
Remote Similarity 0.6716 NPC128368
Remote Similarity 0.6715 NPC45794
Remote Similarity 0.6714 NPC142577
Remote Similarity 0.6713 NPC210950
Remote Similarity 0.6713 NPC199738
Remote Similarity 0.6713 NPC476353
Remote Similarity 0.6711 NPC81026
Remote Similarity 0.6711 NPC27721
Remote Similarity 0.6711 NPC314358
Remote Similarity 0.6707 NPC89831
Remote Similarity 0.6692 NPC475002
Remote Similarity 0.6692 NPC95126
Remote Similarity 0.6692 NPC476198
Remote Similarity 0.6691 NPC280827
Remote Similarity 0.6691 NPC243059
Remote Similarity 0.669 NPC57607
Remote Similarity 0.669 NPC157311
Remote Similarity 0.669 NPC475508
Remote Similarity 0.6689 NPC475413
Remote Similarity 0.6689 NPC314388
Remote Similarity 0.6689 NPC315283
Remote Similarity 0.6689 NPC477367
Remote Similarity 0.6689 NPC232888

Drug Structure

External Identifiers

TTD   DCL000901; DAP001116
DrugBank  
ChEMBL  
IUPHAR/BPS   7459
PharmaGKB  
KEGG Drug  
PubChem CID   3494; 11693
ChEBI  
CAS Number  

Drug Properties

Molecular Weight  318.21
ALogP  -2.7617
MLogP  3.11
XLogP  3.625
HDA  3
HBD  1
Rotatable Bonds  8
TPSA  46.53
RO5 Violation  0