Drug Information

Drug ID:  NPD1762
Drug Name:  Mepivacaine Hydrochloride
Molecular Formula:  C15H22N2O.ClH
Canonical SMILES:  CN1CCCCC1C(=Nc1c(C)cccc1C)O.Cl
Standard InCHI:  InChI=1S/C15H22N2O.ClH/c1-11-7-6-8-12(2)14(11)16-15(18)13-9-4-5-10-17(13)3;/h6-8,13H,4-5,9-10H2,1-3H3,(H,16,18);1H
Standard InCHIKey:  RETIMRUQNCDCQB-UHFFFAOYSA-N
Max Developmental Stage:  Approved
Max Developmental Stage Source:  ChEMBL

  Structural Similarity Between NPASS Natural Products and NPD1762

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 0.7736 NPC78154
Intermediate Similarity 0.7594 NPC243162
Intermediate Similarity 0.7477 NPC470877
Intermediate Similarity 0.7456 NPC178681
Intermediate Similarity 0.7455 NPC303045
Intermediate Similarity 0.7455 NPC161972
Intermediate Similarity 0.7407 NPC121872
Intermediate Similarity 0.7407 NPC209764
Intermediate Similarity 0.7407 NPC78041
Intermediate Similarity 0.7407 NPC74936
Intermediate Similarity 0.7407 NPC471307
Intermediate Similarity 0.7407 NPC159178
Intermediate Similarity 0.7407 NPC141139
Intermediate Similarity 0.7381 NPC283130
Intermediate Similarity 0.7381 NPC328683
Intermediate Similarity 0.7355 NPC205652
Intermediate Similarity 0.7339 NPC226438
Intermediate Similarity 0.7258 NPC264580
Intermediate Similarity 0.7232 NPC25565
Intermediate Similarity 0.7217 NPC291610
Intermediate Similarity 0.7213 NPC470550
Intermediate Similarity 0.7207 NPC476483
Intermediate Similarity 0.7207 NPC471309
Intermediate Similarity 0.7176 NPC226662
Intermediate Similarity 0.7168 NPC311242
Intermediate Similarity 0.7168 NPC475439
Intermediate Similarity 0.7168 NPC473501
Intermediate Similarity 0.7154 NPC478079
Intermediate Similarity 0.7143 NPC164802
Intermediate Similarity 0.7091 NPC316108
Intermediate Similarity 0.7075 NPC15839
Intermediate Similarity 0.7073 NPC33742
Intermediate Similarity 0.7068 NPC476685
Intermediate Similarity 0.7068 NPC476687
Intermediate Similarity 0.7068 NPC476689
Intermediate Similarity 0.7023 NPC476950
Intermediate Similarity 0.7021 NPC472100
Intermediate Similarity 0.7008 NPC316582
Intermediate Similarity 0.7 NPC472103
Remote Similarity 0.6992 NPC35850
Remote Similarity 0.6992 NPC276949
Remote Similarity 0.6972 NPC471638
Remote Similarity 0.6972 NPC254798
Remote Similarity 0.6963 NPC184437
Remote Similarity 0.696 NPC147957
Remote Similarity 0.696 NPC470544
Remote Similarity 0.695 NPC116519
Remote Similarity 0.6934 NPC122553
Remote Similarity 0.6917 NPC37584
Remote Similarity 0.6905 NPC192209
Remote Similarity 0.6905 NPC470545
Remote Similarity 0.6887 NPC307456
Remote Similarity 0.6875 NPC317564
Remote Similarity 0.6871 NPC477156
Remote Similarity 0.6871 NPC477157
Remote Similarity 0.6855 NPC187036
Remote Similarity 0.6855 NPC296163
Remote Similarity 0.685 NPC470546
Remote Similarity 0.6818 NPC473031
Remote Similarity 0.6807 NPC224610
Remote Similarity 0.6807 NPC88267
Remote Similarity 0.6807 NPC194390
Remote Similarity 0.6807 NPC113326
Remote Similarity 0.6786 NPC172128
Remote Similarity 0.6772 NPC313449
Remote Similarity 0.6757 NPC12429
Remote Similarity 0.6757 NPC111233
Remote Similarity 0.6742 NPC474926
Remote Similarity 0.6742 NPC325013
Remote Similarity 0.6726 NPC470926
Remote Similarity 0.6726 NPC245259
Remote Similarity 0.6723 NPC471310
Remote Similarity 0.6723 NPC471317
Remote Similarity 0.6723 NPC202613
Remote Similarity 0.6721 NPC302790
Remote Similarity 0.6719 NPC228515
Remote Similarity 0.6715 NPC313352
Remote Similarity 0.6696 NPC58674
Remote Similarity 0.6695 NPC214200
Remote Similarity 0.6695 NPC228400
Remote Similarity 0.6694 NPC327481
Remote Similarity 0.6693 NPC285926
Remote Similarity 0.6693 NPC315276
Remote Similarity 0.6693 NPC239357
Remote Similarity 0.6693 NPC14672
Remote Similarity 0.6692 NPC71684
Remote Similarity 0.6689 NPC207726
Remote Similarity 0.6667 NPC314431
Remote Similarity 0.6667 NPC264589
Remote Similarity 0.6639 NPC239854
Remote Similarity 0.6623 NPC68650
Remote Similarity 0.6623 NPC477158
Remote Similarity 0.6615 NPC476990
Remote Similarity 0.6614 NPC288232
Remote Similarity 0.661 NPC12730
Remote Similarity 0.6606 NPC104070
Remote Similarity 0.66 NPC129721
Remote Similarity 0.66 NPC153694
Remote Similarity 0.66 NPC104345
Remote Similarity 0.66 NPC211525
Remote Similarity 0.6593 NPC278451
Remote Similarity 0.6593 NPC471313
Remote Similarity 0.6593 NPC471311
Remote Similarity 0.6589 NPC81561
Remote Similarity 0.6577 NPC473297
Remote Similarity 0.6571 NPC271642
Remote Similarity 0.6565 NPC215519
Remote Similarity 0.6565 NPC202521
Remote Similarity 0.6562 NPC313673
Remote Similarity 0.6556 NPC263709
Remote Similarity 0.6556 NPC63210
Remote Similarity 0.6556 NPC243673
Remote Similarity 0.6556 NPC97380
Remote Similarity 0.6556 NPC148468
Remote Similarity 0.6556 NPC67056
Remote Similarity 0.6556 NPC310403
Remote Similarity 0.6549 NPC316202
Remote Similarity 0.6541 NPC317758
Remote Similarity 0.6536 NPC194640
Remote Similarity 0.6533 NPC84317
Remote Similarity 0.6532 NPC292758
Remote Similarity 0.6532 NPC65855
Remote Similarity 0.6531 NPC187951
Remote Similarity 0.6522 NPC324611
Remote Similarity 0.6515 NPC252878
Remote Similarity 0.6512 NPC148140
Remote Similarity 0.6496 NPC316746
Remote Similarity 0.6493 NPC101719
Remote Similarity 0.6489 NPC200964
Remote Similarity 0.648 NPC319579
Remote Similarity 0.6476 NPC98976
Remote Similarity 0.6475 NPC211551
Remote Similarity 0.6471 NPC197680
Remote Similarity 0.6471 NPC469666
Remote Similarity 0.6471 NPC133470
Remote Similarity 0.6471 NPC16667
Remote Similarity 0.6471 NPC476231
Remote Similarity 0.6471 NPC191863
Remote Similarity 0.6471 NPC289776
Remote Similarity 0.6471 NPC259098
Remote Similarity 0.6466 NPC46427
Remote Similarity 0.6466 NPC6975
Remote Similarity 0.6466 NPC469330
Remote Similarity 0.646 NPC325441
Remote Similarity 0.6458 NPC314287
Remote Similarity 0.6454 NPC287358
Remote Similarity 0.6452 NPC278887
Remote Similarity 0.6449 NPC325479
Remote Similarity 0.6447 NPC154478
Remote Similarity 0.6446 NPC164859
Remote Similarity 0.6441 NPC33168
Remote Similarity 0.6441 NPC472258
Remote Similarity 0.6439 NPC475915
Remote Similarity 0.6434 NPC104483
Remote Similarity 0.6433 NPC158129
Remote Similarity 0.6429 NPC189116
Remote Similarity 0.6429 NPC203076
Remote Similarity 0.6424 NPC285469
Remote Similarity 0.6423 NPC474804
Remote Similarity 0.6423 NPC474973
Remote Similarity 0.6423 NPC130898
Remote Similarity 0.6418 NPC222466
Remote Similarity 0.6418 NPC22746
Remote Similarity 0.641 NPC469462
Remote Similarity 0.641 NPC108339
Remote Similarity 0.6406 NPC118202
Remote Similarity 0.64 NPC470127
Remote Similarity 0.6393 NPC275467
Remote Similarity 0.6389 NPC477155
Remote Similarity 0.6387 NPC470508
Remote Similarity 0.6387 NPC52059
Remote Similarity 0.6387 NPC322598
Remote Similarity 0.6387 NPC470069
Remote Similarity 0.6378 NPC474584
Remote Similarity 0.6376 NPC475763
Remote Similarity 0.6372 NPC262295
Remote Similarity 0.6372 NPC17497
Remote Similarity 0.6372 NPC305602
Remote Similarity 0.637 NPC122718
Remote Similarity 0.6364 NPC472121
Remote Similarity 0.6364 NPC326232
Remote Similarity 0.6358 NPC38736
Remote Similarity 0.6358 NPC161827
Remote Similarity 0.6357 NPC101139
Remote Similarity 0.6356 NPC471320
Remote Similarity 0.6356 NPC471319
Remote Similarity 0.6352 NPC329688
Remote Similarity 0.6352 NPC189812
Remote Similarity 0.635 NPC101372
Remote Similarity 0.635 NPC111428
Remote Similarity 0.635 NPC150863
Remote Similarity 0.635 NPC473322
Remote Similarity 0.6348 NPC258627
Remote Similarity 0.6343 NPC474082
Remote Similarity 0.6343 NPC175726
Remote Similarity 0.6341 NPC143516
Remote Similarity 0.6341 NPC476198
Remote Similarity 0.6336 NPC220698
Remote Similarity 0.6335 NPC133261
Remote Similarity 0.6331 NPC207428

Drug Structure

External Identifiers

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

Drug Properties

Molecular Weight  246.17
ALogP  0.3084
MLogP  2.78
XLogP  3.556
HDA  3
HBD  1
Rotatable Bonds  6
TPSA  35.83
RO5 Violation  0