Drug Information

Drug ID:  NPD1421
Drug Name:  Rivastigmine
Molecular Formula:  C14H22N2O2
Canonical SMILES:  CCN(C(=O)Oc1cccc(c1)[C@@H](N(C)C)C)C
Standard InCHI:  InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1
Standard InCHIKey:  XSVMFMHYUFZWBK-NSHDSACASA-N
Max Developmental Stage:  Approved
Max Developmental Stage Source:  ChEMBL; IUPHAR/BPS

  Structural Similarity Between NPASS Natural Products and NPD1421

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
Intermediate Similarity 0.7953 NPC53596
Intermediate Similarity 0.7953 NPC471308
Intermediate Similarity 0.7953 NPC289330
Intermediate Similarity 0.7953 NPC17388
Intermediate Similarity 0.7953 NPC160120
Intermediate Similarity 0.7879 NPC172403
Intermediate Similarity 0.782 NPC471306
Intermediate Similarity 0.782 NPC471321
Intermediate Similarity 0.7805 NPC21890
Intermediate Similarity 0.7769 NPC471314
Intermediate Similarity 0.7769 NPC471315
Intermediate Similarity 0.7761 NPC160193
Intermediate Similarity 0.771 NPC217277
Intermediate Similarity 0.7643 NPC314682
Intermediate Similarity 0.7591 NPC266425
Intermediate Similarity 0.7589 NPC188163
Intermediate Similarity 0.7589 NPC328750
Intermediate Similarity 0.7589 NPC213206
Intermediate Similarity 0.7589 NPC474915
Intermediate Similarity 0.7561 NPC97811
Intermediate Similarity 0.7557 NPC211992
Intermediate Similarity 0.7538 NPC321133
Intermediate Similarity 0.7537 NPC218323
Intermediate Similarity 0.752 NPC269340
Intermediate Similarity 0.7518 NPC118419
Intermediate Similarity 0.75 NPC298486
Intermediate Similarity 0.75 NPC253429
Intermediate Similarity 0.748 NPC186469
Intermediate Similarity 0.7463 NPC124776
Intermediate Similarity 0.7429 NPC7018
Intermediate Similarity 0.7426 NPC283079
Intermediate Similarity 0.7402 NPC26524
Intermediate Similarity 0.7379 NPC185838
Intermediate Similarity 0.7376 NPC252107
Intermediate Similarity 0.7361 NPC136860
Intermediate Similarity 0.7361 NPC476567
Intermediate Similarity 0.7361 NPC128019
Intermediate Similarity 0.7357 NPC11147
Intermediate Similarity 0.7347 NPC475959
Intermediate Similarity 0.7343 NPC470925
Intermediate Similarity 0.7338 NPC160692
Intermediate Similarity 0.7324 NPC231572
Intermediate Similarity 0.7317 NPC42383
Intermediate Similarity 0.7308 NPC120075
Intermediate Similarity 0.7305 NPC137172
Intermediate Similarity 0.7305 NPC145446
Intermediate Similarity 0.7305 NPC99078
Intermediate Similarity 0.7305 NPC131204
Intermediate Similarity 0.7305 NPC301050
Intermediate Similarity 0.7286 NPC167096
Intermediate Similarity 0.7279 NPC106295
Intermediate Similarity 0.7279 NPC191376
Intermediate Similarity 0.7279 NPC179825
Intermediate Similarity 0.7279 NPC51957
Intermediate Similarity 0.7279 NPC476144
Intermediate Similarity 0.7279 NPC210437
Intermediate Similarity 0.7279 NPC476151
Intermediate Similarity 0.7279 NPC321505
Intermediate Similarity 0.7279 NPC16107
Intermediate Similarity 0.7266 NPC93882
Intermediate Similarity 0.7266 NPC130595
Intermediate Similarity 0.726 NPC130926
Intermediate Similarity 0.7254 NPC248505
Intermediate Similarity 0.7254 NPC95366
Intermediate Similarity 0.7254 NPC470707
Intermediate Similarity 0.7254 NPC193528
Intermediate Similarity 0.7254 NPC220923
Intermediate Similarity 0.725 NPC470161
Intermediate Similarity 0.7234 NPC73883
Intermediate Similarity 0.7234 NPC136330
Intermediate Similarity 0.7234 NPC255817
Intermediate Similarity 0.7234 NPC96406
Intermediate Similarity 0.7234 NPC230698
Intermediate Similarity 0.7234 NPC277042
Intermediate Similarity 0.7234 NPC196609
Intermediate Similarity 0.7234 NPC205178
Intermediate Similarity 0.7234 NPC251454
Intermediate Similarity 0.723 NPC7467
Intermediate Similarity 0.723 NPC135538
Intermediate Similarity 0.723 NPC24233
Intermediate Similarity 0.723 NPC246587
Intermediate Similarity 0.723 NPC428
Intermediate Similarity 0.723 NPC147390
Intermediate Similarity 0.723 NPC476571
Intermediate Similarity 0.7214 NPC285078
Intermediate Similarity 0.7214 NPC6854
Intermediate Similarity 0.7214 NPC313737
Intermediate Similarity 0.7214 NPC325568
Intermediate Similarity 0.7188 NPC280760
Intermediate Similarity 0.7183 NPC416184
Intermediate Similarity 0.7181 NPC103379
Intermediate Similarity 0.7181 NPC477565
Intermediate Similarity 0.7163 NPC193673
Intermediate Similarity 0.7163 NPC328419
Intermediate Similarity 0.7163 NPC218530
Intermediate Similarity 0.7163 NPC159150
Intermediate Similarity 0.7163 NPC103947
Intermediate Similarity 0.7163 NPC45783
Intermediate Similarity 0.7163 NPC94280
Intermediate Similarity 0.7162 NPC90844
Intermediate Similarity 0.7162 NPC95075
Intermediate Similarity 0.7162 NPC144863
Intermediate Similarity 0.7162 NPC253883
Intermediate Similarity 0.7143 NPC318862
Intermediate Similarity 0.7143 NPC217574
Intermediate Similarity 0.7133 NPC225745
Intermediate Similarity 0.7133 NPC471316
Intermediate Similarity 0.7133 NPC194359
Intermediate Similarity 0.7133 NPC28641
Intermediate Similarity 0.7113 NPC475828
Intermediate Similarity 0.7113 NPC180647
Intermediate Similarity 0.7086 NPC119669
Intermediate Similarity 0.7086 NPC81733
Intermediate Similarity 0.7086 NPC326316
Intermediate Similarity 0.7086 NPC476579
Intermediate Similarity 0.7075 NPC294249
Intermediate Similarity 0.7073 NPC307425
Intermediate Similarity 0.7071 NPC308885
Intermediate Similarity 0.7071 NPC255550
Intermediate Similarity 0.707 NPC231198
Intermediate Similarity 0.7068 NPC43275
Intermediate Similarity 0.7067 NPC219162
Intermediate Similarity 0.7067 NPC92541
Intermediate Similarity 0.7067 NPC207824
Intermediate Similarity 0.7067 NPC60538
Intermediate Similarity 0.7063 NPC231884
Intermediate Similarity 0.7063 NPC167944
Intermediate Similarity 0.7063 NPC307682
Intermediate Similarity 0.7063 NPC42793
Intermediate Similarity 0.7059 NPC78733
Intermediate Similarity 0.7059 NPC216459
Intermediate Similarity 0.7059 NPC41178
Intermediate Similarity 0.7059 NPC138487
Intermediate Similarity 0.7044 NPC241055
Intermediate Similarity 0.704 NPC288760
Intermediate Similarity 0.704 NPC473855
Intermediate Similarity 0.7039 NPC210148
Intermediate Similarity 0.7039 NPC148898
Intermediate Similarity 0.7039 NPC233029
Intermediate Similarity 0.7029 NPC301713
Intermediate Similarity 0.7021 NPC470392
Intermediate Similarity 0.702 NPC88249
Intermediate Similarity 0.702 NPC192768
Intermediate Similarity 0.702 NPC220858
Intermediate Similarity 0.702 NPC97221
Intermediate Similarity 0.702 NPC151895
Intermediate Similarity 0.702 NPC274026
Intermediate Similarity 0.702 NPC13397
Intermediate Similarity 0.7016 NPC24327
Intermediate Similarity 0.7016 NPC12870
Intermediate Similarity 0.7013 NPC146288
Intermediate Similarity 0.7013 NPC247639
Intermediate Similarity 0.7013 NPC25084
Intermediate Similarity 0.7 NPC262641
Intermediate Similarity 0.7 NPC303522
Remote Similarity 0.6993 NPC470708
Remote Similarity 0.6992 NPC289381
Remote Similarity 0.6992 NPC155847
Remote Similarity 0.6992 NPC107101
Remote Similarity 0.6986 NPC204546
Remote Similarity 0.6978 NPC291847
Remote Similarity 0.6978 NPC153990
Remote Similarity 0.6977 NPC166837
Remote Similarity 0.6975 NPC321956
Remote Similarity 0.6974 NPC76213
Remote Similarity 0.6974 NPC476568
Remote Similarity 0.6974 NPC277669
Remote Similarity 0.6962 NPC168409
Remote Similarity 0.696 NPC292792
Remote Similarity 0.695 NPC476570
Remote Similarity 0.6948 NPC172765
Remote Similarity 0.6948 NPC127674
Remote Similarity 0.6948 NPC276588
Remote Similarity 0.6948 NPC54379
Remote Similarity 0.6948 NPC469817
Remote Similarity 0.6948 NPC5238
Remote Similarity 0.6948 NPC93593
Remote Similarity 0.6948 NPC295691
Remote Similarity 0.6948 NPC193949
Remote Similarity 0.6948 NPC80129
Remote Similarity 0.6948 NPC110416
Remote Similarity 0.6948 NPC278799
Remote Similarity 0.6948 NPC187022
Remote Similarity 0.6948 NPC207757
Remote Similarity 0.6948 NPC76079
Remote Similarity 0.6948 NPC204828
Remote Similarity 0.6948 NPC189266
Remote Similarity 0.6948 NPC249797
Remote Similarity 0.6948 NPC184026
Remote Similarity 0.6948 NPC39701
Remote Similarity 0.6948 NPC2413
Remote Similarity 0.6943 NPC70172
Remote Similarity 0.6934 NPC13020
Remote Similarity 0.6934 NPC140359
Remote Similarity 0.6933 NPC324081
Remote Similarity 0.6929 NPC233320
Remote Similarity 0.6928 NPC133011
Remote Similarity 0.6928 NPC82285
Remote Similarity 0.6928 NPC476580
Remote Similarity 0.6928 NPC26601

Drug Structure

External Identifiers

TTD   DAP000149; DIB002950
DrugBank   DB00989
ChEMBL   CHEMBL636
IUPHAR/BPS   6602
PharmaGKB   PA451262
KEGG Drug   D03822
PubChem CID   77991
ChEBI   8874
CAS Number  123441-03-2

Drug Properties

Molecular Weight  250.17
ALogP  0.5897
MLogP  2.56
XLogP  2.78
HDA  3
HBD  0
Rotatable Bonds  11
TPSA  32.78
RO5 Violation  0