Natural Product: NPC214368

Natural Product ID:  NPC214368
Common Name:   Pitucamycin
IUPAC Name:   (3R,4R,5R)-2-amino-3,4-dihydroxy-5-[[8-(hydroxymethyl)-3-oxophenoxazin-2-yl]amino]-6-oxocyclohexene-1-carboxamide
Synonyms:   Pitucamycin
Molecular Formula:   C20H18N4O7
Standard InCHIKey:  NURWOUVTSOIROK-QXAKKESOSA-N
Standard InCHI:  InChI=1S/C20H18N4O7/c21-15-14(20(22)30)17(27)16(19(29)18(15)28)24-8-4-10-13(5-11(8)26)31-12-2-1-7(6-25)3-9(12)23-10/h1-5,16,18-19,24-25,28-29H,6,21H2,(H2,22,30)/t16-,18+,19+/m0/s1
Canonical SMILES:  OCc1ccc2c(c1)nc1c(o2)cc(=O)c(c1)N[C@@H]1[C@@H](O)[C@H](O)C(=C(C1=O)C(=N)O)N
First Find Year:  
Max Developmental Stage:  
Synthetic Gene Cluster:   ;

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO11355 Homarus americanus Species Nephropidae Eukaryota UNPD*
NPO6787 Neoalsomitra integrifolia Species Cucurbitaceae Eukaryota UNPD*
NPO9320 Weddellina squamulosa Species Podostemaceae Eukaryota UNPD*
NPO8416 Picrorhiza kurrooa Species Plantaginaceae Eukaryota UNPD*
NPO7365 Clibadium pentaneuron Species Asteraceae Eukaryota UNPD*
NPO2805 Distolasterias nipon Species Asteriidae Eukaryota UNPD*
NPO1526 Ratibida latipalearis Species Asteraceae Eukaryota UNPD*
NPO729 Espeletia marcana Species Asteraceae Eukaryota UNPD*
NPO24849 Rhinella paracnemis Species Bufonidae Eukaryota UNPD*
NPO12535 Solanum toxicarium Species Solanaceae Eukaryota UNPD*
NPO7883 Albugo candida Species Albuginaceae Eukaryota UNPD*
NPO1937 Andropogon nardus Species Poaceae Eukaryota UNPD*
NPO12309 Malva crispa Species Malvaceae Eukaryota UNPD*
NPO3202 Nolina erumpens Species Asparagaceae Eukaryota UNPD*
NPO3900 Phellinus xeranticus Species Hymenochaetaceae Eukaryota UNPD*
NPO24652 Toxicodendron succedaneum Species Anacardiaceae Eukaryota UNPD*
NPO10867 Graphis elongata Species Aclididae Eukaryota UNPD*
NPO6232.25 Streptomyces griseus dsm 41823 Subspecies Streptomycetaceae Bacteria StreptomeDB*
NPO6232 Streptomyces griseus Species Streptomycetaceae Bacteria StreptomeDB*
NPO8547 Petasites niveus Species Asteraceae Eukaryota UNPD*
NPO9937 Piptolepis leptospermoides Species Asteraceae Eukaryota UNPD*
NPO12481 Croton californicus Species Euphorbiaceae Eukaryota UNPD*
NPO9603 Croton sparsiflorus Species Euphorbiaceae Eukaryota UNPD*
NPO9020 Eriostemon fitzgeraldii Species Rutaceae Eukaryota UNPD*
NPO9227 Xylaria berteri Species Xylariaceae Eukaryota UNPD*
NPO3333 Aglaia gigantea Species Meliaceae Eukaryota UNPD*
NPO5219 Dendrobium rotundatum Species Orchidaceae Eukaryota UNPD*
NPO18350 Culcitium canescens Species Asteraceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT165 Cell Line HeLa Homo sapiens CC50 = 74800 nM 20715808
NPT111 Cell Line K562 Homo sapiens GI50 = 27600 nM 20715808
NPT737 Cell Line HUVEC Homo sapiens GI50 = 36600 nM 20715808

  Similar Natural Products in NPASS

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

●  The left chart: Distribution of similarity level between NPC214368 and all remaining natural products in the NPASS database.
●  The right table: Most similar natural products (Tc>=0.56 or Top200).

Similarity Score Similarity Level Natural Product ID
0.8315 Intermediate Similarity NPC57105
0.8156 Intermediate Similarity NPC231862
0.8077 Intermediate Similarity NPC314861
0.772 Intermediate Similarity NPC313886
0.7684 Intermediate Similarity NPC315631
0.7638 Intermediate Similarity NPC108847
0.7594 Intermediate Similarity NPC127362
0.7277 Intermediate Similarity NPC314817
0.7277 Intermediate Similarity NPC66191
0.7277 Intermediate Similarity NPC316297
0.7268 Intermediate Similarity NPC8467
0.7171 Intermediate Similarity NPC478049
0.7163 Intermediate Similarity NPC311357
0.7136 Intermediate Similarity NPC469829
0.7107 Intermediate Similarity NPC316161
0.7095 Intermediate Similarity NPC473422
0.7087 Intermediate Similarity NPC314948
0.6966 Remote Similarity NPC208022
0.6927 Remote Similarity NPC297584
0.6915 Remote Similarity NPC469831
0.6897 Remote Similarity NPC262725
0.6885 Remote Similarity NPC314113
0.6863 Remote Similarity NPC469830
0.6859 Remote Similarity NPC10875
0.6859 Remote Similarity NPC10730
0.6835 Remote Similarity NPC326027
0.682 Remote Similarity NPC326333
0.6796 Remote Similarity NPC283207
0.6765 Remote Similarity NPC477391
0.6739 Remote Similarity NPC47986
0.6738 Remote Similarity NPC119569
0.673 Remote Similarity NPC323662
0.6729 Remote Similarity NPC473460
0.6714 Remote Similarity NPC472330
0.6714 Remote Similarity NPC472329
0.67 Remote Similarity NPC472163
0.6685 Remote Similarity NPC307123
0.6685 Remote Similarity NPC247018
0.6685 Remote Similarity NPC97870
0.6684 Remote Similarity NPC473804
0.6683 Remote Similarity NPC83241
0.6682 Remote Similarity NPC470746
0.6682 Remote Similarity NPC471336
0.6667 Remote Similarity NPC471532
0.6651 Remote Similarity NPC477160
0.665 Remote Similarity NPC204179
0.6634 Remote Similarity NPC477392
0.6634 Remote Similarity NPC315934
0.6633 Remote Similarity NPC471568
0.6633 Remote Similarity NPC473693
0.663 Remote Similarity NPC313466
0.6622 Remote Similarity NPC471531
0.662 Remote Similarity NPC87714
0.6619 Remote Similarity NPC328763
0.6617 Remote Similarity NPC95412
0.6602 Remote Similarity NPC315542
0.6602 Remote Similarity NPC299806
0.6602 Remote Similarity NPC235194
0.6598 Remote Similarity NPC56635
0.6591 Remote Similarity NPC92235
0.6579 Remote Similarity NPC245974
0.6568 Remote Similarity NPC469722
0.6567 Remote Similarity NPC248670
0.656 Remote Similarity NPC478075
0.6553 Remote Similarity NPC41501
0.6524 Remote Similarity NPC189724
0.6524 Remote Similarity NPC83289
0.6524 Remote Similarity NPC212850
0.6518 Remote Similarity NPC321226
0.6518 Remote Similarity NPC328856
0.6518 Remote Similarity NPC478047
0.6518 Remote Similarity NPC478046
0.6518 Remote Similarity NPC180210
0.6518 Remote Similarity NPC314914
0.6515 Remote Similarity NPC158900
0.6514 Remote Similarity NPC195787
0.6514 Remote Similarity NPC246140
0.6509 Remote Similarity NPC475843
0.6497 Remote Similarity NPC306366
0.6495 Remote Similarity NPC477550
0.6495 Remote Similarity NPC477552
0.6489 Remote Similarity NPC284236
0.6489 Remote Similarity NPC316368
0.6482 Remote Similarity NPC254700
0.648 Remote Similarity NPC70549
0.6476 Remote Similarity NPC174629
0.6474 Remote Similarity NPC247298
0.6473 Remote Similarity NPC478048
0.6471 Remote Similarity NPC291609
0.6468 Remote Similarity NPC314702
0.6468 Remote Similarity NPC196091
0.6465 Remote Similarity NPC133470
0.6465 Remote Similarity NPC191863
0.6465 Remote Similarity NPC289776
0.6463 Remote Similarity NPC122886
0.6462 Remote Similarity NPC474678
0.6462 Remote Similarity NPC471338
0.6457 Remote Similarity NPC30749
0.6456 Remote Similarity NPC270301
0.6452 Remote Similarity NPC474077
0.6445 Remote Similarity NPC475411
0.6445 Remote Similarity NPC28510
0.644 Remote Similarity NPC9373
0.6438 Remote Similarity NPC472286
0.6438 Remote Similarity NPC472287
0.6435 Remote Similarity NPC477551
0.6432 Remote Similarity NPC470441
0.6432 Remote Similarity NPC170101
0.6429 Remote Similarity NPC124300
0.6429 Remote Similarity NPC112766
0.6425 Remote Similarity NPC315632
0.6422 Remote Similarity NPC168153
0.6418 Remote Similarity NPC186617
0.6413 Remote Similarity NPC274732
0.6411 Remote Similarity NPC276120
0.6404 Remote Similarity NPC99724
0.6404 Remote Similarity NPC273755
0.6402 Remote Similarity NPC470023
0.6402 Remote Similarity NPC316224
0.6402 Remote Similarity NPC204546
0.6396 Remote Similarity NPC25961
0.6393 Remote Similarity NPC14339
0.6389 Remote Similarity NPC123859
0.6384 Remote Similarity NPC217903
0.638 Remote Similarity NPC329567
0.638 Remote Similarity NPC330683
0.6376 Remote Similarity NPC148124
0.6372 Remote Similarity NPC470021
0.6371 Remote Similarity NPC470784
0.6368 Remote Similarity NPC473378
0.6368 Remote Similarity NPC218303
0.6368 Remote Similarity NPC473407
0.6368 Remote Similarity NPC146418
0.6364 Remote Similarity NPC301163
0.6364 Remote Similarity NPC26928
0.6364 Remote Similarity NPC477161
0.636 Remote Similarity NPC313627
0.636 Remote Similarity NPC274268
0.6359 Remote Similarity NPC45037
0.6359 Remote Similarity NPC269750
0.6359 Remote Similarity NPC194671
0.6359 Remote Similarity NPC123140
0.6359 Remote Similarity NPC242728
0.6359 Remote Similarity NPC475421
0.6359 Remote Similarity NPC471337
0.6356 Remote Similarity NPC176113
0.6354 Remote Similarity NPC320242
0.6354 Remote Similarity NPC473769
0.6351 Remote Similarity NPC471561
0.635 Remote Similarity NPC139506
0.635 Remote Similarity NPC292143
0.6349 Remote Similarity NPC469360
0.6349 Remote Similarity NPC310618
0.6344 Remote Similarity NPC77777
0.6341 Remote Similarity NPC50016
0.6339 Remote Similarity NPC116178
0.6339 Remote Similarity NPC305542
0.6336 Remote Similarity NPC248903
0.6335 Remote Similarity NPC16249
0.6335 Remote Similarity NPC257266
0.6329 Remote Similarity NPC184680
0.6327 Remote Similarity NPC471335
0.6327 Remote Similarity NPC288349
0.6324 Remote Similarity NPC73280
0.6324 Remote Similarity NPC470392
0.6324 Remote Similarity NPC471953
0.6321 Remote Similarity NPC132771
0.6321 Remote Similarity NPC474059
0.632 Remote Similarity NPC19175
0.6316 Remote Similarity NPC294951
0.6313 Remote Similarity NPC317727
0.6311 Remote Similarity NPC9475
0.6307 Remote Similarity NPC208522
0.6306 Remote Similarity NPC257728
0.6305 Remote Similarity NPC46009
0.6304 Remote Similarity NPC473987
0.6303 Remote Similarity NPC301501
0.6303 Remote Similarity NPC470785
0.6301 Remote Similarity NPC472435
0.6301 Remote Similarity NPC288759
0.6296 Remote Similarity NPC472191
0.6296 Remote Similarity NPC144314
0.6293 Remote Similarity NPC473354
0.6293 Remote Similarity NPC314222
0.6293 Remote Similarity NPC266994
0.6293 Remote Similarity NPC471165
0.6293 Remote Similarity NPC158277
0.6293 Remote Similarity NPC196449
0.6291 Remote Similarity NPC70340
0.6289 Remote Similarity NPC324081
0.6286 Remote Similarity NPC138083
0.6286 Remote Similarity NPC133591
0.6278 Remote Similarity NPC153365
0.6277 Remote Similarity NPC473055
0.6277 Remote Similarity NPC473052
0.6272 Remote Similarity NPC469594
0.6269 Remote Similarity NPC17760
0.6269 Remote Similarity NPC472923
0.6268 Remote Similarity NPC470903
0.6268 Remote Similarity NPC314659

  Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

●  The left chart: Distribution of similarity level between NPC214368 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

Similarity Score Similarity Level Drug ID Developmental Stage
0.7865 Intermediate Similarity NPD3154 Approved
0.7865 Intermediate Similarity NPD3153 Approved
0.7568 Intermediate Similarity NPD3560 Approved
0.7568 Intermediate Similarity NPD3557 Approved
0.7568 Intermediate Similarity NPD3558 Approved
0.7568 Intermediate Similarity NPD3559 Clinical (unspecified phase)
0.7568 Intermediate Similarity NPD3556 Approved
0.7426 Intermediate Similarity NPD4604 Approved
0.7426 Intermediate Similarity NPD4605 Approved
0.7382 Intermediate Similarity NPD2215 Approved
0.7382 Intermediate Similarity NPD2216 Approved
0.73 Intermediate Similarity NPD4258 Approved
0.73 Intermediate Similarity NPD4259 Approved
0.7277 Intermediate Similarity NPD2249 Approved
0.7277 Intermediate Similarity NPD2247 Approved
0.7241 Intermediate Similarity NPD7256 Discontinued
0.7184 Intermediate Similarity NPD5547 Clinical (unspecified phase)
0.7115 Intermediate Similarity NPD7476 Discontinued
0.7062 Intermediate Similarity NPD4606 Clinical (unspecified phase)
0.7037 Intermediate Similarity NPD3778 Approved
0.7015 Intermediate Similarity NPD6045 Phase 3
0.7014 Intermediate Similarity NPD4465 Phase 2
0.7014 Intermediate Similarity NPD4467 Phase 2
0.6995 Remote Similarity NPD6593 Clinical (unspecified phase)
0.6948 Remote Similarity NPD7043 Discontinued
0.6946 Remote Similarity NPD6793 Clinical (unspecified phase)
0.6939 Remote Similarity NPD4083 Discontinued
0.6934 Remote Similarity NPD7891 Discontinued
0.6923 Remote Similarity NPD1422 Approved
0.6923 Remote Similarity NPD6034 Phase 2
0.6912 Remote Similarity NPD1898 Discontinued
0.6884 Remote Similarity NPD3965 Phase 1
0.6881 Remote Similarity NPD5895 Clinical (unspecified phase)
0.6875 Remote Similarity NPD6283 Phase 2
0.6872 Remote Similarity NPD7566 Clinical (unspecified phase)
0.6866 Remote Similarity NPD6104 Discontinued
0.6861 Remote Similarity NPD7547 Clinical (unspecified phase)
0.6859 Remote Similarity NPD2541 Clinical (unspecified phase)
0.6839 Remote Similarity NPD1012 Discontinued
0.6829 Remote Similarity NPD5558 Clinical (unspecified phase)
0.6816 Remote Similarity NPD6211 Clinical (unspecified phase)
0.6796 Remote Similarity NPD2843 Phase 2
0.6796 Remote Similarity NPD2845 Phase 2
0.6784 Remote Similarity NPD6199 Discontinued
0.6783 Remote Similarity NPD7853 Phase 2
0.6777 Remote Similarity NPD7810 Phase 3
0.6777 Remote Similarity NPD7811 Phase 3
0.6776 Remote Similarity NPD5102 Clinical (unspecified phase)
0.6771 Remote Similarity NPD980 Clinical (unspecified phase)
0.6759 Remote Similarity NPD2514 Approved
0.6751 Remote Similarity NPD2680 Approved
0.6751 Remote Similarity NPD2681 Approved
0.6745 Remote Similarity NPD6519 Phase 2
0.6745 Remote Similarity NPD2339 Phase 3
0.6743 Remote Similarity NPD4502 Phase 2
0.67 Remote Similarity NPD5192 Clinical (unspecified phase)
0.67 Remote Similarity NPD2525 Clinical (unspecified phase)
0.6685 Remote Similarity NPD1423 Approved
0.6683 Remote Similarity NPD5641 Discontinued
0.6682 Remote Similarity NPD5845 Phase 2
0.6682 Remote Similarity NPD4979 Clinical (unspecified phase)
0.6682 Remote Similarity NPD3945 Discontinued
0.6667 Remote Similarity NPD3180 Approved
0.6667 Remote Similarity NPD7318 Phase 3
0.6667 Remote Similarity NPD3179 Approved
0.6667 Remote Similarity NPD7883 Discontinued
0.6667 Remote Similarity NPD3052 Approved
0.6667 Remote Similarity NPD3054 Approved
0.6635 Remote Similarity NPD6136 Phase 2
0.6635 Remote Similarity NPD7880 Clinical (unspecified phase)
0.6632 Remote Similarity NPD3536 Discontinued
0.6631 Remote Similarity NPD2459 Approved
0.6631 Remote Similarity NPD2976 Clinical (unspecified phase)
0.6631 Remote Similarity NPD2458 Approved
0.6631 Remote Similarity NPD2460 Phase 3
0.6622 Remote Similarity NPD7475 Clinical (unspecified phase)
0.662 Remote Similarity NPD6874 Approved
0.6619 Remote Similarity NPD5150 Phase 2
0.6597 Remote Similarity NPD4186 Clinical (unspecified phase)
0.6592 Remote Similarity NPD6719 Approved
0.6591 Remote Similarity NPD1945 Phase 1
0.6591 Remote Similarity NPD5416 Discontinued
0.6587 Remote Similarity NPD6608 Clinical (unspecified phase)
0.6584 Remote Similarity NPD8461 Discontinued
0.6583 Remote Similarity NPD7484 Phase 3
0.6583 Remote Similarity NPD7485 Phase 3
0.6579 Remote Similarity NPD3263 Phase 3
0.6574 Remote Similarity NPD3802 Phase 3
0.6567 Remote Similarity NPD2248 Approved
0.6567 Remote Similarity NPD2246 Approved
0.6565 Remote Similarity NPD5022 Discontinued
0.6564 Remote Similarity NPD7317 Phase 3
0.6564 Remote Similarity NPD1769 Discontinued
0.6559 Remote Similarity NPD2239 Approved
0.6559 Remote Similarity NPD2240 Approved
0.6553 Remote Similarity NPD7546 Discontinued
0.6549 Remote Similarity NPD7556 Discontinued
0.6538 Remote Similarity NPD4587 Phase 3
0.6538 Remote Similarity NPD3863 Clinical (unspecified phase)
0.6531 Remote Similarity NPD6060 Clinical (unspecified phase)
0.653 Remote Similarity NPD4082 Approved
0.6528 Remote Similarity NPD5848 Clinical (unspecified phase)
0.6528 Remote Similarity NPD6863 Phase 2
0.6528 Remote Similarity NPD6510 Phase 1
0.6528 Remote Similarity NPD5267 Discontinued
0.6528 Remote Similarity NPD6511 Phase 1
0.6528 Remote Similarity NPD7316 Discontinued
0.6528 Remote Similarity NPD4003 Phase 3
0.6526 Remote Similarity NPD5872 Discontinued
0.6518 Remote Similarity NPD3949 Clinical (unspecified phase)
0.6513 Remote Similarity NPD4255 Phase 1
0.651 Remote Similarity NPD9509 Clinical (unspecified phase)
0.6507 Remote Similarity NPD3490 Discontinued
0.6507 Remote Similarity NPD5640 Discontinued
0.6504 Remote Similarity NPD3783 Clinical (unspecified phase)
0.6498 Remote Similarity NPD6289 Clinical (unspecified phase)
0.6497 Remote Similarity NPD6063 Approved
0.6493 Remote Similarity NPD4740 Approved
0.649 Remote Similarity NPD6339 Approved
0.649 Remote Similarity NPD6340 Approved
0.6489 Remote Similarity NPD6198 Phase 1
0.6488 Remote Similarity NPD5553 Clinical (unspecified phase)
0.6488 Remote Similarity NPD3823 Discontinued
0.6488 Remote Similarity NPD6654 Clinical (unspecified phase)
0.6485 Remote Similarity NPD3451 Clinical (unspecified phase)
0.6484 Remote Similarity NPD2434 Approved
0.6479 Remote Similarity NPD3659 Discontinued
0.6478 Remote Similarity NPD7994 Phase 2
0.6477 Remote Similarity NPD7131 Phase 3
0.6474 Remote Similarity NPD5160 Discontinued
0.6471 Remote Similarity NPD5645 Phase 3
0.6471 Remote Similarity NPD3175 Clinical (unspecified phase)
0.6468 Remote Similarity NPD7608 Discontinued
0.6465 Remote Similarity NPD7565 Approved
0.6462 Remote Similarity NPD4466 Phase 1
0.6459 Remote Similarity NPD4515 Suspended
0.6458 Remote Similarity NPD4661 Approved
0.6458 Remote Similarity NPD4662 Approved
0.6458 Remote Similarity NPD3985 Discontinued
0.6458 Remote Similarity NPD2874 Phase 2
0.6453 Remote Similarity NPD5938 Phase 3
0.6452 Remote Similarity NPD8162 Phase 2
0.6452 Remote Similarity NPD8163 Clinical (unspecified phase)
0.645 Remote Similarity NPD2162 Clinical (unspecified phase)
0.6449 Remote Similarity NPD6621 Clinical (unspecified phase)
0.6448 Remote Similarity NPD3056 Clinical (unspecified phase)
0.6447 Remote Similarity NPD2842 Clinical (unspecified phase)
0.6447 Remote Similarity NPD8311 Discontinued
0.6445 Remote Similarity NPD5871 Discontinued
0.6442 Remote Similarity NPD4586 Phase 3
0.6438 Remote Similarity NPD6807 Phase 3
0.6438 Remote Similarity NPD7031 Phase 1
0.6436 Remote Similarity NPD2388 Discontinued
0.6435 Remote Similarity NPD7186 Phase 3
0.6429 Remote Similarity NPD5417 Clinical (unspecified phase)
0.6429 Remote Similarity NPD4157 Discontinued
0.6429 Remote Similarity NPD6716 Phase 1
0.6422 Remote Similarity NPD3909 Discontinued
0.6422 Remote Similarity NPD7589 Clinical (unspecified phase)
0.6418 Remote Similarity NPD2821 Approved
0.6411 Remote Similarity NPD6967 Phase 2
0.6409 Remote Similarity NPD7584 Approved
0.6409 Remote Similarity NPD7263 Phase 2
0.6404 Remote Similarity NPD5078 Clinical (unspecified phase)
0.6404 Remote Similarity NPD3952 Approved
0.6404 Remote Similarity NPD3953 Clinical (unspecified phase)
0.6404 Remote Similarity NPD3951 Phase 3
0.6402 Remote Similarity NPD8249 Clinical (unspecified phase)
0.64 Remote Similarity NPD8149 Discontinued
0.6398 Remote Similarity NPD7628 Phase 3
0.6398 Remote Similarity NPD7630 Phase 3
0.6398 Remote Similarity NPD7629 Clinical (unspecified phase)
0.6393 Remote Similarity NPD6644 Discontinued
0.6392 Remote Similarity NPD8330 Clinical (unspecified phase)
0.6391 Remote Similarity NPD4505 Phase 1
0.6388 Remote Similarity NPD6974 Phase 3
0.638 Remote Similarity NPD4022 Approved
0.638 Remote Similarity NPD7300 Phase 3
0.638 Remote Similarity NPD3472 Approved
0.638 Remote Similarity NPD2907 Approved
0.638 Remote Similarity NPD7302 Phase 3
0.638 Remote Similarity NPD2906 Approved
0.6377 Remote Similarity NPD7039 Approved
0.6377 Remote Similarity NPD7038 Approved
0.6376 Remote Similarity NPD6795 Clinical (unspecified phase)
0.6376 Remote Similarity NPD7626 Approved
0.6376 Remote Similarity NPD7627 Approved
0.6374 Remote Similarity NPD4993 Discontinued
0.6373 Remote Similarity NPD4123 Phase 3
0.6373 Remote Similarity NPD5348 Clinical (unspecified phase)
0.6372 Remote Similarity NPD3940 Clinical (unspecified phase)
0.6372 Remote Similarity NPD5650 Approved
0.6372 Remote Similarity NPD5651 Approved
0.6372 Remote Similarity NPD5652 Approved
0.6364 Remote Similarity NPD6905 Phase 2
0.636 Remote Similarity NPD5433 Clinical (unspecified phase)
0.6359 Remote Similarity NPD5557 Phase 1
0.6356 Remote Similarity NPD4679 Discontinued
0.6354 Remote Similarity NPD1817 Approved
0.6354 Remote Similarity NPD1819 Approved

Structure

External Identifiers

PubChem CID   46939682
ChEMBL   CHEMBL1224596
ZINC  

Physicochemical Properties

Molecular Weight:  426.12
ALogP:  -4.0124
MLogP:  2.45
XLogP:  1.861
# Rotatable Bonds:  9
Polar Surface Area:  198.55
# H-Bond Aceptor:  10
# H-Bond Donor:  7
# Rings:  4
# Heavy Atoms:  31

Download Data

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Biological Activities  
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