Drug Information

Drug ID:  NPD191
Drug Name:  Chlorphenesin Carbamate
Molecular Formula:  C10H12ClNO4
Canonical SMILES:  OC(COC(=N)O)COc1ccc(cc1)Cl
Standard InCHI:  InChI=1S/C10H12ClNO4/c11-7-1-3-9(4-2-7)15-5-8(13)6-16-10(12)14/h1-4,8,13H,5-6H2,(H2,12,14)
Standard InCHIKey:  SKPLBLUECSEIFO-UHFFFAOYSA-N
Max Developmental Stage:  Approved
Max Developmental Stage Source:  ChEMBL

  Structural Similarity Between NPASS Natural Products and NPD191

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 0.7944 NPC318429
Intermediate Similarity 0.7826 NPC41594
Intermediate Similarity 0.7787 NPC204617
Intermediate Similarity 0.7561 NPC161768
Intermediate Similarity 0.7459 NPC142319
Intermediate Similarity 0.7456 NPC132725
Intermediate Similarity 0.7311 NPC194034
Intermediate Similarity 0.7304 NPC314803
Intermediate Similarity 0.7288 NPC17537
Intermediate Similarity 0.728 NPC9248
Intermediate Similarity 0.7273 NPC46844
Intermediate Similarity 0.7222 NPC228907
Intermediate Similarity 0.7188 NPC205213
Intermediate Similarity 0.7163 NPC473874
Intermediate Similarity 0.7109 NPC60589
Intermediate Similarity 0.7109 NPC469708
Intermediate Similarity 0.7054 NPC198734
Intermediate Similarity 0.7054 NPC469412
Intermediate Similarity 0.7054 NPC269242
Intermediate Similarity 0.7 NPC57751
Intermediate Similarity 0.7 NPC226712
Remote Similarity 0.694 NPC198798
Remote Similarity 0.6923 NPC276195
Remote Similarity 0.6909 NPC125306
Remote Similarity 0.6909 NPC38459
Remote Similarity 0.6891 NPC51633
Remote Similarity 0.688 NPC115379
Remote Similarity 0.6875 NPC206876
Remote Similarity 0.6842 NPC25817
Remote Similarity 0.6842 NPC221090
Remote Similarity 0.6842 NPC235370
Remote Similarity 0.6842 NPC287429
Remote Similarity 0.6833 NPC192596
Remote Similarity 0.6825 NPC301735
Remote Similarity 0.6822 NPC101503
Remote Similarity 0.6818 NPC152722
Remote Similarity 0.681 NPC114325
Remote Similarity 0.6791 NPC470510
Remote Similarity 0.678 NPC313918
Remote Similarity 0.6777 NPC38079
Remote Similarity 0.6777 NPC108875
Remote Similarity 0.6767 NPC192810
Remote Similarity 0.6767 NPC217854
Remote Similarity 0.6759 NPC124576
Remote Similarity 0.6757 NPC23837
Remote Similarity 0.6741 NPC233559
Remote Similarity 0.6741 NPC298845
Remote Similarity 0.6739 NPC193334
Remote Similarity 0.6723 NPC307039
Remote Similarity 0.6721 NPC470393
Remote Similarity 0.6721 NPC8302
Remote Similarity 0.6714 NPC264956
Remote Similarity 0.6692 NPC476142
Remote Similarity 0.6692 NPC151237
Remote Similarity 0.6691 NPC37074
Remote Similarity 0.6691 NPC66643
Remote Similarity 0.6691 NPC140750
Remote Similarity 0.6667 NPC141739
Remote Similarity 0.6667 NPC473653
Remote Similarity 0.6667 NPC136112
Remote Similarity 0.6667 NPC12308
Remote Similarity 0.6667 NPC320242
Remote Similarity 0.6667 NPC157213
Remote Similarity 0.6667 NPC55300
Remote Similarity 0.6642 NPC302378
Remote Similarity 0.6642 NPC198487
Remote Similarity 0.6642 NPC247146
Remote Similarity 0.6642 NPC40377
Remote Similarity 0.6642 NPC146540
Remote Similarity 0.6639 NPC283546
Remote Similarity 0.6618 NPC189589
Remote Similarity 0.6618 NPC469622
Remote Similarity 0.6618 NPC171533
Remote Similarity 0.6614 NPC165646
Remote Similarity 0.6613 NPC251306
Remote Similarity 0.6609 NPC302546
Remote Similarity 0.6607 NPC33756
Remote Similarity 0.6594 NPC97326
Remote Similarity 0.6594 NPC166040
Remote Similarity 0.6594 NPC26653
Remote Similarity 0.6594 NPC270849
Remote Similarity 0.6594 NPC218003
Remote Similarity 0.6594 NPC295970
Remote Similarity 0.6594 NPC248355
Remote Similarity 0.6585 NPC307875
Remote Similarity 0.6583 NPC100870
Remote Similarity 0.6573 NPC36434
Remote Similarity 0.6565 NPC329980
Remote Similarity 0.6547 NPC60756
Remote Similarity 0.6547 NPC470079
Remote Similarity 0.6547 NPC472024
Remote Similarity 0.6547 NPC80600
Remote Similarity 0.6547 NPC474491
Remote Similarity 0.6538 NPC175771
Remote Similarity 0.6538 NPC290470
Remote Similarity 0.6538 NPC154256
Remote Similarity 0.6528 NPC298821
Remote Similarity 0.6525 NPC16649
Remote Similarity 0.6522 NPC47422
Remote Similarity 0.6515 NPC163036
Remote Similarity 0.6512 NPC235250
Remote Similarity 0.6512 NPC313193
Remote Similarity 0.6508 NPC474272
Remote Similarity 0.65 NPC307123
Remote Similarity 0.65 NPC97870
Remote Similarity 0.65 NPC9912
Remote Similarity 0.65 NPC121376
Remote Similarity 0.65 NPC287780
Remote Similarity 0.65 NPC95755
Remote Similarity 0.65 NPC247018
Remote Similarity 0.65 NPC166168
Remote Similarity 0.6496 NPC322888
Remote Similarity 0.6489 NPC142042
Remote Similarity 0.6483 NPC123761
Remote Similarity 0.6483 NPC195814
Remote Similarity 0.648 NPC258171
Remote Similarity 0.648 NPC227894
Remote Similarity 0.6475 NPC473987
Remote Similarity 0.6471 NPC293701
Remote Similarity 0.6471 NPC48990
Remote Similarity 0.6471 NPC114901
Remote Similarity 0.6462 NPC301321
Remote Similarity 0.6457 NPC88868
Remote Similarity 0.6457 NPC25067
Remote Similarity 0.6457 NPC231251
Remote Similarity 0.6454 NPC273984
Remote Similarity 0.6454 NPC26080
Remote Similarity 0.6454 NPC165686
Remote Similarity 0.6454 NPC303422
Remote Similarity 0.6454 NPC269421
Remote Similarity 0.6454 NPC162093
Remote Similarity 0.6454 NPC85799
Remote Similarity 0.6452 NPC473855
Remote Similarity 0.6452 NPC128730
Remote Similarity 0.6449 NPC469621
Remote Similarity 0.6446 NPC471576
Remote Similarity 0.6444 NPC90577
Remote Similarity 0.6444 NPC71090
Remote Similarity 0.6444 NPC27198
Remote Similarity 0.6429 NPC262606
Remote Similarity 0.6429 NPC208769
Remote Similarity 0.6429 NPC291837
Remote Similarity 0.6429 NPC146530
Remote Similarity 0.6423 NPC278552
Remote Similarity 0.6423 NPC167571
Remote Similarity 0.6423 NPC305205
Remote Similarity 0.6423 NPC207179
Remote Similarity 0.6418 NPC199023
Remote Similarity 0.6418 NPC473875
Remote Similarity 0.6408 NPC60982
Remote Similarity 0.6408 NPC115022
Remote Similarity 0.6408 NPC25821
Remote Similarity 0.6408 NPC49074
Remote Similarity 0.6408 NPC294166
Remote Similarity 0.6408 NPC2363
Remote Similarity 0.6406 NPC78918
Remote Similarity 0.6406 NPC139617
Remote Similarity 0.64 NPC176971
Remote Similarity 0.64 NPC232654
Remote Similarity 0.6397 NPC212176
Remote Similarity 0.6393 NPC107101
Remote Similarity 0.6391 NPC135961
Remote Similarity 0.6391 NPC24474
Remote Similarity 0.6391 NPC37858
Remote Similarity 0.6391 NPC311595
Remote Similarity 0.6378 NPC149545
Remote Similarity 0.6377 NPC8058
Remote Similarity 0.637 NPC14287
Remote Similarity 0.637 NPC470804
Remote Similarity 0.637 NPC290451
Remote Similarity 0.637 NPC127389
Remote Similarity 0.6364 NPC130496
Remote Similarity 0.6364 NPC476411
Remote Similarity 0.6364 NPC87696
Remote Similarity 0.6364 NPC34456
Remote Similarity 0.6364 NPC471029
Remote Similarity 0.6364 NPC188555
Remote Similarity 0.6364 NPC187194
Remote Similarity 0.6357 NPC266116
Remote Similarity 0.6357 NPC307110
Remote Similarity 0.6351 NPC136951
Remote Similarity 0.6351 NPC161155
Remote Similarity 0.6351 NPC97004
Remote Similarity 0.635 NPC109822
Remote Similarity 0.635 NPC94276
Remote Similarity 0.6349 NPC151530
Remote Similarity 0.6349 NPC157473
Remote Similarity 0.6349 NPC124712
Remote Similarity 0.6343 NPC177475
Remote Similarity 0.6343 NPC35071
Remote Similarity 0.6343 NPC148615
Remote Similarity 0.6343 NPC193193
Remote Similarity 0.6341 NPC307425
Remote Similarity 0.6338 NPC299144
Remote Similarity 0.6331 NPC147821
Remote Similarity 0.6331 NPC111247
Remote Similarity 0.6331 NPC183181
Remote Similarity 0.6331 NPC118787
Remote Similarity 0.6331 NPC41706
Remote Similarity 0.6331 NPC319625

Drug Structure

External Identifiers

TTD   DIB014859
DrugBank  
ChEMBL  
IUPHAR/BPS  
PharmaGKB  
KEGG Drug  
PubChem CID  
ChEBI  
CAS Number  

Drug Properties

Molecular Weight  245.05
ALogP  0.5719
MLogP  1.9
XLogP  2.063
HDA  4
HBD  3
Rotatable Bonds  9
TPSA  82.77
RO5 Violation  0