Drug Information

Drug ID:  NPD2110
Drug Name:  Chloropyramine
Molecular Formula:  C16H20ClN3
Canonical SMILES:  CN(CCN(c1ccccn1)Cc1ccc(cc1)Cl)C
Standard InCHI:  InChI=1S/C16H20ClN3/c1-19(2)11-12-20(16-5-3-4-10-18-16)13-14-6-8-15(17)9-7-14/h3-10H,11-13H2,1-2H3
Standard InCHIKey:  ICKFFNBDFNZJSX-UHFFFAOYSA-N
Max Developmental Stage:  Approved
Max Developmental Stage Source:  DrugBank

  Structural Similarity Between NPASS Natural Products and NPD2110

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 0.8425 NPC315348
Intermediate Similarity 0.8425 NPC32002
Intermediate Similarity 0.7736 NPC476464
Intermediate Similarity 0.7682 NPC471312
Intermediate Similarity 0.7589 NPC471402
Intermediate Similarity 0.7589 NPC297486
Intermediate Similarity 0.7589 NPC240136
Intermediate Similarity 0.7586 NPC476322
Intermediate Similarity 0.7535 NPC91958
Intermediate Similarity 0.7467 NPC471322
Intermediate Similarity 0.7467 NPC101165
Intermediate Similarity 0.7464 NPC27802
Intermediate Similarity 0.7447 NPC84268
Intermediate Similarity 0.7423 NPC477591
Intermediate Similarity 0.7413 NPC143603
Intermediate Similarity 0.7397 NPC290094
Intermediate Similarity 0.7396 NPC317054
Intermediate Similarity 0.7379 NPC265605
Intermediate Similarity 0.7379 NPC182570
Intermediate Similarity 0.7379 NPC48564
Intermediate Similarity 0.7333 NPC476131
Intermediate Similarity 0.7321 NPC116961
Intermediate Similarity 0.7285 NPC69914
Intermediate Similarity 0.7261 NPC476454
Intermediate Similarity 0.7248 NPC169625
Intermediate Similarity 0.7248 NPC202957
Intermediate Similarity 0.7246 NPC76540
Intermediate Similarity 0.7226 NPC314102
Intermediate Similarity 0.7226 NPC251722
Intermediate Similarity 0.7211 NPC329825
Intermediate Similarity 0.7162 NPC46358
Intermediate Similarity 0.7152 NPC89490
Intermediate Similarity 0.7134 NPC316811
Intermediate Similarity 0.7105 NPC475105
Intermediate Similarity 0.7105 NPC329896
Intermediate Similarity 0.7105 NPC475090
Intermediate Similarity 0.7086 NPC471311
Intermediate Similarity 0.7086 NPC471313
Intermediate Similarity 0.7067 NPC166424
Intermediate Similarity 0.7067 NPC245244
Intermediate Similarity 0.7067 NPC146373
Intermediate Similarity 0.7059 NPC282398
Intermediate Similarity 0.7024 NPC470203
Intermediate Similarity 0.7 NPC27740
Remote Similarity 0.6993 NPC235843
Remote Similarity 0.6964 NPC470204
Remote Similarity 0.6951 NPC40070
Remote Similarity 0.6949 NPC471609
Remote Similarity 0.6903 NPC256893
Remote Similarity 0.6899 NPC150259
Remote Similarity 0.6829 NPC470111
Remote Similarity 0.6812 NPC83987
Remote Similarity 0.6761 NPC231655
Remote Similarity 0.6727 NPC201380
Remote Similarity 0.6727 NPC179787
Remote Similarity 0.6726 NPC476297
Remote Similarity 0.6726 NPC476219
Remote Similarity 0.6708 NPC73767
Remote Similarity 0.6707 NPC470233
Remote Similarity 0.6707 NPC204141
Remote Similarity 0.6688 NPC324611
Remote Similarity 0.6687 NPC20144
Remote Similarity 0.6687 NPC321911
Remote Similarity 0.6687 NPC65408
Remote Similarity 0.6667 NPC469779
Remote Similarity 0.6667 NPC469761
Remote Similarity 0.6667 NPC122141
Remote Similarity 0.6667 NPC143872
Remote Similarity 0.6667 NPC469767
Remote Similarity 0.6667 NPC63545
Remote Similarity 0.6667 NPC469783
Remote Similarity 0.6667 NPC469768
Remote Similarity 0.6667 NPC469784
Remote Similarity 0.6667 NPC469780
Remote Similarity 0.6648 NPC314919
Remote Similarity 0.6648 NPC16659
Remote Similarity 0.6646 NPC169433
Remote Similarity 0.6644 NPC81561
Remote Similarity 0.6632 NPC469308
Remote Similarity 0.6628 NPC225018
Remote Similarity 0.6627 NPC120070
Remote Similarity 0.6627 NPC469811
Remote Similarity 0.6627 NPC477974
Remote Similarity 0.6626 NPC469766
Remote Similarity 0.6605 NPC110126
Remote Similarity 0.6592 NPC265710
Remote Similarity 0.659 NPC478182
Remote Similarity 0.6584 NPC84911
Remote Similarity 0.6577 NPC148140
Remote Similarity 0.6568 NPC325903
Remote Similarity 0.6562 NPC198988
Remote Similarity 0.655 NPC469897
Remote Similarity 0.655 NPC129721
Remote Similarity 0.6538 NPC212125
Remote Similarity 0.6527 NPC114209
Remote Similarity 0.6522 NPC261195
Remote Similarity 0.6522 NPC29886
Remote Similarity 0.6522 NPC96102
Remote Similarity 0.6519 NPC307191
Remote Similarity 0.6514 NPC49217
Remote Similarity 0.6512 NPC300238
Remote Similarity 0.6512 NPC56765
Remote Similarity 0.6506 NPC86288
Remote Similarity 0.6503 NPC104483
Remote Similarity 0.6481 NPC105127
Remote Similarity 0.6478 NPC82295
Remote Similarity 0.6471 NPC314058
Remote Similarity 0.6471 NPC316359
Remote Similarity 0.6471 NPC316018
Remote Similarity 0.6471 NPC315617
Remote Similarity 0.6467 NPC476566
Remote Similarity 0.6457 NPC2165
Remote Similarity 0.6457 NPC195507
Remote Similarity 0.6453 NPC236711
Remote Similarity 0.645 NPC53947
Remote Similarity 0.6448 NPC108011
Remote Similarity 0.6446 NPC471323
Remote Similarity 0.6444 NPC473380
Remote Similarity 0.6444 NPC240088
Remote Similarity 0.642 NPC325252
Remote Similarity 0.6416 NPC293487
Remote Similarity 0.6415 NPC315320
Remote Similarity 0.6412 NPC469975
Remote Similarity 0.6407 NPC314372
Remote Similarity 0.6405 NPC215519
Remote Similarity 0.6402 NPC88097
Remote Similarity 0.64 NPC90723
Remote Similarity 0.6398 NPC472289
Remote Similarity 0.6395 NPC51054
Remote Similarity 0.6391 NPC282531
Remote Similarity 0.6386 NPC190296
Remote Similarity 0.6386 NPC477977
Remote Similarity 0.6382 NPC162689
Remote Similarity 0.6382 NPC54102
Remote Similarity 0.638 NPC125746
Remote Similarity 0.6376 NPC473901
Remote Similarity 0.6369 NPC288838
Remote Similarity 0.6364 NPC279081
Remote Similarity 0.6364 NPC2949
Remote Similarity 0.6364 NPC59084
Remote Similarity 0.6353 NPC24678
Remote Similarity 0.6353 NPC105818
Remote Similarity 0.6346 NPC122718
Remote Similarity 0.6343 NPC124542
Remote Similarity 0.6343 NPC59779
Remote Similarity 0.6343 NPC471177
Remote Similarity 0.634 NPC471617
Remote Similarity 0.6337 NPC229055
Remote Similarity 0.6329 NPC306397
Remote Similarity 0.6328 NPC478183
Remote Similarity 0.6325 NPC473868
Remote Similarity 0.6325 NPC63157
Remote Similarity 0.6322 NPC318065
Remote Similarity 0.6322 NPC206819
Remote Similarity 0.6313 NPC82331
Remote Similarity 0.631 NPC285731
Remote Similarity 0.6307 NPC478184
Remote Similarity 0.6307 NPC317105
Remote Similarity 0.6304 NPC83381
Remote Similarity 0.6301 NPC115049
Remote Similarity 0.6298 NPC280852
Remote Similarity 0.6286 NPC44773
Remote Similarity 0.6286 NPC215584
Remote Similarity 0.6279 NPC138842
Remote Similarity 0.6279 NPC25008
Remote Similarity 0.6279 NPC469763
Remote Similarity 0.6279 NPC469765
Remote Similarity 0.6279 NPC469760
Remote Similarity 0.6279 NPC259644
Remote Similarity 0.6279 NPC469786
Remote Similarity 0.6279 NPC73952
Remote Similarity 0.6279 NPC200214
Remote Similarity 0.6278 NPC313730
Remote Similarity 0.6271 NPC471178
Remote Similarity 0.6266 NPC135488
Remote Similarity 0.6265 NPC230002
Remote Similarity 0.6264 NPC286427
Remote Similarity 0.6257 NPC164664
Remote Similarity 0.6257 NPC91895
Remote Similarity 0.625 NPC478185
Remote Similarity 0.6243 NPC75540
Remote Similarity 0.6243 NPC70922
Remote Similarity 0.6243 NPC211572
Remote Similarity 0.6243 NPC80597
Remote Similarity 0.6243 NPC212376
Remote Similarity 0.6236 NPC98187
Remote Similarity 0.6236 NPC56233
Remote Similarity 0.6235 NPC322488
Remote Similarity 0.6235 NPC471957
Remote Similarity 0.6229 NPC41257
Remote Similarity 0.6226 NPC165370
Remote Similarity 0.6225 NPC288232
Remote Similarity 0.622 NPC216159
Remote Similarity 0.622 NPC29702
Remote Similarity 0.6215 NPC247987
Remote Similarity 0.6213 NPC159856
Remote Similarity 0.6213 NPC469525
Remote Similarity 0.6213 NPC470440
Remote Similarity 0.6213 NPC467188
Remote Similarity 0.6209 NPC474958

Drug Structure

External Identifiers

TTD  
DrugBank   DB08800
ChEMBL   CHEMBL1194287
IUPHAR/BPS  
PharmaGKB   PA165958419
KEGG Drug   D07195
PubChem CID  
ChEBI   94767
CAS Number  59-32-5

Drug Properties

Molecular Weight  289.13
ALogP  1.0101
MLogP  2.78
XLogP  3.723
HDA  3
HBD  0
Rotatable Bonds  9
TPSA  19.37
RO5 Violation  0