Drug Information

Drug ID:  NPD6187
Drug Name:  Cefpiramide Sodium
Molecular Formula:  C25H24N8O7S2.Na
Canonical SMILES:  [O-]c1ccc(cc1)[C@H](C(=N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)CSc1nnnn1C)O)N=C(c1c[nH]c(cc1=O)C)O.[Na+]
Standard InCHI:  InChI=1S/C25H24N8O7S2.Na/c1-11-7-16(35)15(8-26-11)20(36)27-17(12-3-5-14(34)6-4-12)21(37)28-18-22(38)33-19(24(39)40)13(9-41-23(18)33)10-42-25-29-30-31-32(25)2;/h3-8,17-18,23,34H,9-10H2,1-2H3,(H,26,35)(H,27,36)(H,28,37)(H,39,40);/q;+1/p-1/t17-,18-,23-;/m1./s1
Standard InCHIKey:  RIWWMGQFMUUYIY-ALLHVENQSA-M
Max Developmental Stage:  Approved
Max Developmental Stage Source:  ChEMBL

  Structural Similarity Between NPASS Natural Products and NPD6187

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 0.7989 NPC315388
Intermediate Similarity 0.7287 NPC13470
Intermediate Similarity 0.7143 NPC478005
Intermediate Similarity 0.7143 NPC153554
Intermediate Similarity 0.7022 NPC478007
Remote Similarity 0.696 NPC478008
Remote Similarity 0.6897 NPC475532
Remote Similarity 0.6878 NPC468984
Remote Similarity 0.6863 NPC165285
Remote Similarity 0.6832 NPC129486
Remote Similarity 0.678 NPC17698
Remote Similarity 0.6768 NPC323336
Remote Similarity 0.6768 NPC326349
Remote Similarity 0.6723 NPC475196
Remote Similarity 0.6716 NPC274198
Remote Similarity 0.6716 NPC198254
Remote Similarity 0.67 NPC469243
Remote Similarity 0.6683 NPC223207
Remote Similarity 0.6667 NPC196243
Remote Similarity 0.6667 NPC477638
Remote Similarity 0.6667 NPC477632
Remote Similarity 0.665 NPC471771
Remote Similarity 0.665 NPC290755
Remote Similarity 0.665 NPC304074
Remote Similarity 0.6636 NPC329295
Remote Similarity 0.6634 NPC276506
Remote Similarity 0.6617 NPC475544
Remote Similarity 0.6583 NPC473580
Remote Similarity 0.6558 NPC477636
Remote Similarity 0.6498 NPC477631
Remote Similarity 0.6488 NPC61004
Remote Similarity 0.6484 NPC477639
Remote Similarity 0.648 NPC119569
Remote Similarity 0.648 NPC83790
Remote Similarity 0.648 NPC128237
Remote Similarity 0.6465 NPC94862
Remote Similarity 0.6462 NPC477637
Remote Similarity 0.6429 NPC473804
Remote Similarity 0.6425 NPC280022
Remote Similarity 0.6411 NPC248670
Remote Similarity 0.6404 NPC244336
Remote Similarity 0.6392 NPC476989
Remote Similarity 0.6389 NPC329731
Remote Similarity 0.6383 NPC478141
Remote Similarity 0.6382 NPC473491
Remote Similarity 0.6381 NPC158277
Remote Similarity 0.6368 NPC97526
Remote Similarity 0.6368 NPC119652
Remote Similarity 0.636 NPC14877
Remote Similarity 0.636 NPC145178
Remote Similarity 0.636 NPC475350
Remote Similarity 0.6359 NPC63931
Remote Similarity 0.6356 NPC143325
Remote Similarity 0.6348 NPC251036
Remote Similarity 0.6344 NPC471155
Remote Similarity 0.6337 NPC244509
Remote Similarity 0.633 NPC61332
Remote Similarity 0.633 NPC240130
Remote Similarity 0.6316 NPC270241
Remote Similarity 0.6313 NPC16188
Remote Similarity 0.6313 NPC311658
Remote Similarity 0.6313 NPC4910
Remote Similarity 0.6308 NPC473404
Remote Similarity 0.63 NPC225400
Remote Similarity 0.6298 NPC328649
Remote Similarity 0.6291 NPC194671
Remote Similarity 0.6291 NPC269750
Remote Similarity 0.629 NPC184933
Remote Similarity 0.629 NPC59827
Remote Similarity 0.6289 NPC242159
Remote Similarity 0.6289 NPC313694
Remote Similarity 0.6283 NPC75498
Remote Similarity 0.6272 NPC470786
Remote Similarity 0.6272 NPC472538
Remote Similarity 0.6269 NPC233702
Remote Similarity 0.6256 NPC60516
Remote Similarity 0.6244 NPC302715
Remote Similarity 0.624 NPC314056
Remote Similarity 0.6238 NPC202198
Remote Similarity 0.6238 NPC475204
Remote Similarity 0.6238 NPC475123
Remote Similarity 0.6238 NPC56685
Remote Similarity 0.6232 NPC191863
Remote Similarity 0.6232 NPC289776
Remote Similarity 0.6232 NPC133470
Remote Similarity 0.6227 NPC477526
Remote Similarity 0.6226 NPC279871
Remote Similarity 0.6212 NPC471680
Remote Similarity 0.621 NPC102959
Remote Similarity 0.6209 NPC89831
Remote Similarity 0.6208 NPC323244
Remote Similarity 0.6205 NPC477527
Remote Similarity 0.6202 NPC189116
Remote Similarity 0.6198 NPC478011
Remote Similarity 0.619 NPC66490
Remote Similarity 0.6186 NPC475564
Remote Similarity 0.6186 NPC475409
Remote Similarity 0.6186 NPC170302
Remote Similarity 0.6184 NPC241794
Remote Similarity 0.6179 NPC137627
Remote Similarity 0.6176 NPC469903
Remote Similarity 0.6174 NPC314176
Remote Similarity 0.6173 NPC48202
Remote Similarity 0.6173 NPC477516
Remote Similarity 0.6173 NPC328924
Remote Similarity 0.6169 NPC478013
Remote Similarity 0.6161 NPC46009
Remote Similarity 0.6158 NPC261934
Remote Similarity 0.6158 NPC5194
Remote Similarity 0.615 NPC471165
Remote Similarity 0.6111 NPC39822
Remote Similarity 0.6103 NPC306804
Remote Similarity 0.6102 NPC153400
Remote Similarity 0.6098 NPC476268
Remote Similarity 0.6093 NPC473546
Remote Similarity 0.6087 NPC246303
Remote Similarity 0.6078 NPC262166
Remote Similarity 0.6075 NPC478012
Remote Similarity 0.6075 NPC26108
Remote Similarity 0.6073 NPC299806
Remote Similarity 0.6066 NPC141957
Remote Similarity 0.6062 NPC477550
Remote Similarity 0.6062 NPC477552
Remote Similarity 0.6058 NPC469902
Remote Similarity 0.6051 NPC267237
Remote Similarity 0.605 NPC266741
Remote Similarity 0.6049 NPC39431
Remote Similarity 0.6047 NPC50016
Remote Similarity 0.6045 NPC472789
Remote Similarity 0.604 NPC9373
Remote Similarity 0.6033 NPC319232
Remote Similarity 0.6033 NPC24370
Remote Similarity 0.6031 NPC326966
Remote Similarity 0.6028 NPC273755
Remote Similarity 0.6027 NPC471049
Remote Similarity 0.6027 NPC328763
Remote Similarity 0.6027 NPC294951
Remote Similarity 0.6027 NPC471048
Remote Similarity 0.6027 NPC471050
Remote Similarity 0.602 NPC81026
Remote Similarity 0.602 NPC470441
Remote Similarity 0.6019 NPC254700
Remote Similarity 0.6018 NPC96275
Remote Similarity 0.6018 NPC78767
Remote Similarity 0.6018 NPC473814
Remote Similarity 0.6016 NPC314882
Remote Similarity 0.6009 NPC477551
Remote Similarity 0.6009 NPC40234
Remote Similarity 0.6 NPC295548
Remote Similarity 0.6 NPC136797
Remote Similarity 0.6 NPC315542
Remote Similarity 0.6 NPC313587
Remote Similarity 0.6 NPC235194
Remote Similarity 0.6 NPC315893
Remote Similarity 0.6 NPC476227
Remote Similarity 0.6 NPC316110
Remote Similarity 0.5991 NPC209463
Remote Similarity 0.5991 NPC294516
Remote Similarity 0.5991 NPC107938
Remote Similarity 0.5991 NPC302597
Remote Similarity 0.5991 NPC45037
Remote Similarity 0.5981 NPC230611
Remote Similarity 0.598 NPC7817
Remote Similarity 0.598 NPC475168
Remote Similarity 0.5974 NPC257511
Remote Similarity 0.5964 NPC163961
Remote Similarity 0.5964 NPC51047
Remote Similarity 0.5964 NPC473305
Remote Similarity 0.5962 NPC469904
Remote Similarity 0.596 NPC77992
Remote Similarity 0.5955 NPC302235
Remote Similarity 0.5941 NPC248601
Remote Similarity 0.5935 NPC473693
Remote Similarity 0.5935 NPC471568
Remote Similarity 0.593 NPC214988
Remote Similarity 0.5929 NPC93390
Remote Similarity 0.5928 NPC325651
Remote Similarity 0.5928 NPC300315
Remote Similarity 0.5926 NPC326407
Remote Similarity 0.5926 NPC317725
Remote Similarity 0.5926 NPC473402
Remote Similarity 0.5921 NPC323662
Remote Similarity 0.5907 NPC328494
Remote Similarity 0.5905 NPC473003
Remote Similarity 0.5905 NPC114806
Remote Similarity 0.5902 NPC324081
Remote Similarity 0.5901 NPC150308
Remote Similarity 0.5898 NPC477630
Remote Similarity 0.5898 NPC477635
Remote Similarity 0.5897 NPC469444
Remote Similarity 0.5896 NPC472923
Remote Similarity 0.5894 NPC470902
Remote Similarity 0.5893 NPC329961
Remote Similarity 0.5893 NPC122427
Remote Similarity 0.5893 NPC471195
Remote Similarity 0.5893 NPC471196
Remote Similarity 0.589 NPC469445
Remote Similarity 0.5887 NPC284888
Remote Similarity 0.5887 NPC323752
Remote Similarity 0.5885 NPC324850

Drug Structure

External Identifiers

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

Drug Properties

Molecular Weight  611.11
ALogP  -1.4478
MLogP  2.34
XLogP  0.875
HDA  14
HBD  4
Rotatable Bonds  15
TPSA  269.15
RO5 Violation  1