Natural Product: NPC163296

Natural Product ID:  NPC163296
Common Name:   Oxyphyllanene D
IUPAC Name:   (1aS,4aS,7S,8aS)-7-hydroxy-1a,4a-dimethyl-7-prop-1-en-2-yl-4,5,6,8-tetrahydro-3H-naphtho[1,8a-b]oxiren-2-one
Synonyms:   Oxyphyllanene D
Molecular Formula:   C15H22O3
Standard InCHIKey:  DBHHTOBDSZOWSJ-KBXIAJHMSA-N
Standard InCHI:  InChI=1S/C15H22O3/c1-10(2)14(17)8-7-12(3)6-5-11(16)13(4)15(12,9-14)18-13/h17H,1,5-9H2,2-4H3/t12-,13-,14+,15+/m1/s1
Canonical SMILES:  CC(=C)[C@]1(O)CC[C@@]2([C@]3(C1)O[C@]3(C)C(=O)CC2)C
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
NPO28259 Viguiera pinnatilobata Species Asteraceae Eukaryota UNPD*
NPO24843 Pachygone dasycarpa Species Menispermaceae Eukaryota UNPD*
NPO27031 Methanosarcina barkeri Species Methanosarcinaceae Archaea UNPD*
NPO25106 Arnica parryi Species Asteraceae Eukaryota UNPD*
NPO24456 Salvia lavandulifolia Species Lamiaceae Eukaryota UNPD*
NPO22924 Bombus terrestris Species Apidae Eukaryota UNPD*
NPO23149 Callistemon coccineus Species Myrtaceae Eukaryota UNPD*
NPO24969 Ageratum mexicanum Species Asteraceae Eukaryota UNPD*
NPO24406 Rhizophora tagal Species Rhizophoraceae Eukaryota UNPD*
NPO22715 Alpinia oxyphylla Species Zingiberaceae Eukaryota PMID[22277277]
NPO24813 Agardhiella tenera Species Solieriaceae Eukaryota UNPD*
NPO24118 Buxus hildebrandtii Species Buxaceae Eukaryota UNPD*
NPO24754 Tsitsikamma favus Species Latrunculiidae Eukaryota UNPD*
NPO25031 Petunia nyctaginiflora Species Solanaceae Eukaryota UNPD*
NPO25068 Zebrina pendula Species Enidae Eukaryota UNPD*
NPO23288 Justicia betonica Species Acanthaceae Eukaryota UNPD*
NPO25130 Hylotrupes bajulus Species Cerambycidae Eukaryota UNPD*
NPO29503 Alstonia spectabilis Species Apocynaceae Eukaryota UNPD*
NPO24900 Vladimiria muliensis NA NA NA UNPD*
NPO24021 Eucryphia cordifolia Species Cunoniaceae Eukaryota UNPD*
NPO19716 Uvaria lucida Species Annonaceae Eukaryota UNPD*
NPO27093 Kniphofia foliosa Species Asphodelaceae Eukaryota UNPD*
NPO18045 Holothuria atra Species Holothuriidae Eukaryota UNPD*
NPO17445 Streptomyces corchorusii Species Streptomycetaceae Bacteria UNPD*
NPO24191 Drypetes tessmanniana Species Putranjivaceae Eukaryota UNPD*
NPO27277 Stenocarpella maydis Species Diaporthaceae Eukaryota UNPD*
NPO24589 Grindelia discoidea Species Asteraceae Eukaryota UNPD*
NPO23547 Strychnos amazonica Species Loganiaceae Eukaryota UNPD*
NPO22715 Alpinia oxyphylla Species Zingiberaceae Eukaryota UNPD*
NPO21483 Nonomuraea dietziae Species Streptosporangiaceae Bacteria UNPD*
NPO23660 Alpinia zerumbet Species Zingiberaceae Eukaryota UNPD*
NPO24268 Pteryxia terebinthina Species Apiaceae Eukaryota UNPD*
NPO24559 Cotinus coggygria Species Anacardiaceae Eukaryota UNPD*
NPO24659 Eremurus chinensis Species Asphodelaceae Eukaryota UNPD*
NPO25226 Kalanchoe spathulata Species Crassulaceae Eukaryota UNPD*
NPO21242 Neolitsea villosa Species Lauraceae Eukaryota UNPD*
NPO24937 Callicarpa acuminata Species Lamiaceae Eukaryota UNPD*
NPO24688 Streptomyces ramocissimus Species Streptomycetaceae Bacteria UNPD*
NPO24493 Echinacea simulata Species Asteraceae Eukaryota UNPD*
NPO13455 Hemiselmis virescens Species Hemiselmidaceae Eukaryota UNPD*
NPO1674 Dalbergia nitidula Species Fabaceae Eukaryota UNPD*
NPO21799 Bacillus litoralis Species Bacillaceae Bacteria UNPD*
NPO23478 Uncaria africana Species Rubiaceae Eukaryota UNPD*
NPO23750 Escontria chiotilla Species Cactaceae Eukaryota UNPD*
NPO22375 Saussurea salicifolia Species Asteraceae Eukaryota UNPD*
NPO24874 Croton geayi Species Euphorbiaceae Eukaryota UNPD*
NPO24328 Gratiola officinalis Species Plantaginaceae Eukaryota UNPD*
NPO23657 Ophiocordyceps heteropoda Species Ophiocordycipitaceae Eukaryota UNPD*
NPO23837 Rubus laciniatus Species Rosaceae Eukaryota UNPD*
NPO23375 Hypericum reptans Species Hypericaceae Eukaryota UNPD*
NPO18875 Aconitum contortum Species Ranunculaceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT113 Cell Line RAW264.7 Mus musculus IC50 = 9.85 ug/ml 22277277

  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 NPC163296 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
0.8105 Intermediate Similarity NPC190080
0.8105 Intermediate Similarity NPC111187
0.8095 Intermediate Similarity NPC78935
0.7978 Intermediate Similarity NPC475689
0.7816 Intermediate Similarity NPC275243
0.7711 Intermediate Similarity NPC163020
0.77 Intermediate Similarity NPC469985
0.7692 Intermediate Similarity NPC157476
0.7677 Intermediate Similarity NPC112613
0.767 Intermediate Similarity NPC16657
0.767 Intermediate Similarity NPC204652
0.7629 Intermediate Similarity NPC260223
0.7629 Intermediate Similarity NPC94337
0.7573 Intermediate Similarity NPC153587
0.7551 Intermediate Similarity NPC471916
0.7549 Intermediate Similarity NPC50535
0.7547 Intermediate Similarity NPC477266
0.7525 Intermediate Similarity NPC266
0.7525 Intermediate Similarity NPC131366
0.75 Intermediate Similarity NPC475958
0.75 Intermediate Similarity NPC207885
0.75 Intermediate Similarity NPC87335
0.75 Intermediate Similarity NPC147272
0.7476 Intermediate Similarity NPC201908
0.7476 Intermediate Similarity NPC176949
0.7475 Intermediate Similarity NPC477653
0.7475 Intermediate Similarity NPC17183
0.7451 Intermediate Similarity NPC47281
0.7429 Intermediate Similarity NPC100908
0.7423 Intermediate Similarity NPC258674
0.7423 Intermediate Similarity NPC469982
0.74 Intermediate Similarity NPC293890
0.74 Intermediate Similarity NPC37047
0.74 Intermediate Similarity NPC41971
0.74 Intermediate Similarity NPC180733
0.7396 Intermediate Similarity NPC198054
0.7379 Intermediate Similarity NPC37600
0.7374 Intermediate Similarity NPC236176
0.7368 Intermediate Similarity NPC194642
0.7347 Intermediate Similarity NPC272617
0.7347 Intermediate Similarity NPC90014
0.7347 Intermediate Similarity NPC56369
0.7327 Intermediate Similarity NPC46848
0.7327 Intermediate Similarity NPC75941
0.7327 Intermediate Similarity NPC121218
0.7327 Intermediate Similarity NPC253886
0.7315 Intermediate Similarity NPC80650
0.7308 Intermediate Similarity NPC251824
0.7308 Intermediate Similarity NPC86852
0.7303 Intermediate Similarity NPC475725
0.73 Intermediate Similarity NPC472028
0.73 Intermediate Similarity NPC474793
0.729 Intermediate Similarity NPC40608
0.7283 Intermediate Similarity NPC107253
0.7282 Intermediate Similarity NPC283850
0.7273 Intermediate Similarity NPC477264
0.7273 Intermediate Similarity NPC240509
0.7273 Intermediate Similarity NPC272411
0.7273 Intermediate Similarity NPC219353
0.7263 Intermediate Similarity NPC477614
0.7263 Intermediate Similarity NPC226491
0.7255 Intermediate Similarity NPC275990
0.7255 Intermediate Similarity NPC478176
0.7248 Intermediate Similarity NPC270478
0.7245 Intermediate Similarity NPC475118
0.7245 Intermediate Similarity NPC293086
0.7238 Intermediate Similarity NPC289702
0.7238 Intermediate Similarity NPC322903
0.7238 Intermediate Similarity NPC102843
0.7238 Intermediate Similarity NPC208461
0.7234 Intermediate Similarity NPC475729
0.7234 Intermediate Similarity NPC474215
0.7229 Intermediate Similarity NPC103734
0.7228 Intermediate Similarity NPC94906
0.7222 Intermediate Similarity NPC159333
0.7216 Intermediate Similarity NPC476934
0.7212 Intermediate Similarity NPC28791
0.7212 Intermediate Similarity NPC284365
0.7212 Intermediate Similarity NPC123726
0.7212 Intermediate Similarity NPC295366
0.72 Intermediate Similarity NPC474921
0.72 Intermediate Similarity NPC170978
0.72 Intermediate Similarity NPC136781
0.7196 Intermediate Similarity NPC171888
0.7196 Intermediate Similarity NPC146945
0.7172 Intermediate Similarity NPC197158
0.7172 Intermediate Similarity NPC217329
0.7172 Intermediate Similarity NPC470229
0.7172 Intermediate Similarity NPC470232
0.7172 Intermediate Similarity NPC471624
0.717 Intermediate Similarity NPC20192
0.7159 Intermediate Similarity NPC39362
0.7157 Intermediate Similarity NPC39683
0.7157 Intermediate Similarity NPC14634
0.7157 Intermediate Similarity NPC236585
0.7157 Intermediate Similarity NPC111292
0.7157 Intermediate Similarity NPC295276
0.7143 Intermediate Similarity NPC78966
0.7143 Intermediate Similarity NPC473165
0.7143 Intermediate Similarity NPC284732
0.7143 Intermediate Similarity NPC199543
0.713 Intermediate Similarity NPC225049
0.713 Intermediate Similarity NPC476964
0.7129 Intermediate Similarity NPC38471
0.7129 Intermediate Similarity NPC28864
0.7129 Intermediate Similarity NPC474724
0.7129 Intermediate Similarity NPC89099
0.7129 Intermediate Similarity NPC20479
0.7129 Intermediate Similarity NPC98837
0.7129 Intermediate Similarity NPC264378
0.7129 Intermediate Similarity NPC162459
0.7129 Intermediate Similarity NPC38296
0.7129 Intermediate Similarity NPC471038
0.7128 Intermediate Similarity NPC224345
0.7117 Intermediate Similarity NPC251310
0.7117 Intermediate Similarity NPC470776
0.7115 Intermediate Similarity NPC474281
0.7113 Intermediate Similarity NPC100313
0.7113 Intermediate Similarity NPC46758
0.7113 Intermediate Similarity NPC153853
0.7113 Intermediate Similarity NPC477444
0.7113 Intermediate Similarity NPC477442
0.7113 Intermediate Similarity NPC477433
0.7103 Intermediate Similarity NPC130302
0.71 Intermediate Similarity NPC473964
0.71 Intermediate Similarity NPC329910
0.71 Intermediate Similarity NPC165616
0.71 Intermediate Similarity NPC93245
0.7091 Intermediate Similarity NPC179626
0.7087 Intermediate Similarity NPC286519
0.7087 Intermediate Similarity NPC214946
0.7087 Intermediate Similarity NPC124544
0.7087 Intermediate Similarity NPC170615
0.7087 Intermediate Similarity NPC76866
0.7087 Intermediate Similarity NPC304832
0.7087 Intermediate Similarity NPC246736
0.7087 Intermediate Similarity NPC164551
0.7087 Intermediate Similarity NPC148628
0.7087 Intermediate Similarity NPC88203
0.7083 Intermediate Similarity NPC50847
0.7075 Intermediate Similarity NPC37628
0.7071 Intermediate Similarity NPC103527
0.7071 Intermediate Similarity NPC470385
0.7071 Intermediate Similarity NPC215271
0.7071 Intermediate Similarity NPC272635
0.7071 Intermediate Similarity NPC289539
0.7071 Intermediate Similarity NPC111524
0.7071 Intermediate Similarity NPC153775
0.7071 Intermediate Similarity NPC261333
0.7071 Intermediate Similarity NPC29247
0.7071 Intermediate Similarity NPC469596
0.7071 Intermediate Similarity NPC280804
0.7071 Intermediate Similarity NPC148000
0.7071 Intermediate Similarity NPC169751
0.7071 Intermediate Similarity NPC91772
0.7071 Intermediate Similarity NPC101233
0.7071 Intermediate Similarity NPC24861
0.7071 Intermediate Similarity NPC470386
0.7071 Intermediate Similarity NPC129004
0.7071 Intermediate Similarity NPC292374
0.7071 Intermediate Similarity NPC225474
0.7071 Intermediate Similarity NPC104371
0.7064 Intermediate Similarity NPC208998
0.7064 Intermediate Similarity NPC7921
0.7064 Intermediate Similarity NPC477126
0.7059 Intermediate Similarity NPC55503
0.7059 Intermediate Similarity NPC477656
0.7059 Intermediate Similarity NPC156324
0.7059 Intermediate Similarity NPC293866
0.7059 Intermediate Similarity NPC472972
0.7059 Intermediate Similarity NPC46761
0.7053 Intermediate Similarity NPC34190
0.7048 Intermediate Similarity NPC138908
0.7048 Intermediate Similarity NPC85529
0.7048 Intermediate Similarity NPC200957
0.7048 Intermediate Similarity NPC285927
0.7048 Intermediate Similarity NPC32006
0.7041 Intermediate Similarity NPC26865
0.7037 Intermediate Similarity NPC476023
0.7037 Intermediate Similarity NPC207689
0.7037 Intermediate Similarity NPC474229
0.7037 Intermediate Similarity NPC470281
0.7037 Intermediate Similarity NPC317107
0.703 Intermediate Similarity NPC10864
0.703 Intermediate Similarity NPC474395
0.703 Intermediate Similarity NPC253586
0.703 Intermediate Similarity NPC473963
0.7027 Intermediate Similarity NPC470775
0.7027 Intermediate Similarity NPC477116
0.7027 Intermediate Similarity NPC27999
0.7027 Intermediate Similarity NPC176513
0.7021 Intermediate Similarity NPC97505
0.7021 Intermediate Similarity NPC251170
0.7019 Intermediate Similarity NPC99510
0.7019 Intermediate Similarity NPC72842
0.7019 Intermediate Similarity NPC87927
0.7019 Intermediate Similarity NPC139347
0.7019 Intermediate Similarity NPC96217
0.701 Intermediate Similarity NPC477443
0.701 Intermediate Similarity NPC475108

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC163296 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
0.7238 Intermediate Similarity NPD5345 Clinical (unspecified phase)
0.6762 Remote Similarity NPD5211 Phase 2
0.6729 Remote Similarity NPD6402 Approved
0.6729 Remote Similarity NPD7128 Approved
0.6729 Remote Similarity NPD5739 Approved
0.6729 Remote Similarity NPD6675 Approved
0.6699 Remote Similarity NPD4755 Approved
0.6696 Remote Similarity NPD6319 Approved
0.6696 Remote Similarity NPD6054 Approved
0.6696 Remote Similarity NPD6059 Approved
0.6667 Remote Similarity NPD5697 Approved
0.6667 Remote Similarity NPD5701 Approved
0.6638 Remote Similarity NPD6015 Approved
0.6638 Remote Similarity NPD6016 Approved
0.6636 Remote Similarity NPD5141 Approved
0.6636 Remote Similarity NPD4634 Approved
0.6606 Remote Similarity NPD7320 Approved
0.6606 Remote Similarity NPD6899 Approved
0.6606 Remote Similarity NPD6881 Approved
0.6581 Remote Similarity NPD6370 Approved
0.6581 Remote Similarity NPD5988 Approved
0.6571 Remote Similarity NPD5286 Approved
0.6571 Remote Similarity NPD4700 Approved
0.6571 Remote Similarity NPD4696 Approved
0.6571 Remote Similarity NPD5285 Approved
0.6545 Remote Similarity NPD6012 Approved
0.6545 Remote Similarity NPD6373 Approved
0.6545 Remote Similarity NPD6013 Approved
0.6545 Remote Similarity NPD6372 Approved
0.6545 Remote Similarity NPD6014 Approved
0.6509 Remote Similarity NPD1700 Approved
0.6496 Remote Similarity NPD6921 Approved
0.6486 Remote Similarity NPD7102 Approved
0.6486 Remote Similarity NPD7290 Approved
0.6486 Remote Similarity NPD6883 Approved
0.6471 Remote Similarity NPD7492 Approved
0.6465 Remote Similarity NPD3573 Approved
0.6455 Remote Similarity NPD6011 Approved
0.6449 Remote Similarity NPD5225 Approved
0.6449 Remote Similarity NPD5226 Approved
0.6449 Remote Similarity NPD5224 Approved
0.6449 Remote Similarity NPD4633 Approved
0.6429 Remote Similarity NPD6617 Approved
0.6429 Remote Similarity NPD8130 Phase 1
0.6429 Remote Similarity NPD6650 Approved
0.6429 Remote Similarity NPD6649 Approved
0.6429 Remote Similarity NPD6869 Approved
0.6429 Remote Similarity NPD6847 Approved
0.6422 Remote Similarity NPD6008 Approved
0.6417 Remote Similarity NPD6616 Approved
0.6396 Remote Similarity NPD4061 Clinical (unspecified phase)
0.6389 Remote Similarity NPD5174 Approved
0.6389 Remote Similarity NPD5175 Approved
0.6387 Remote Similarity NPD8328 Phase 3
0.6372 Remote Similarity NPD8297 Approved
0.6372 Remote Similarity NPD6882 Approved
0.6364 Remote Similarity NPD7078 Approved
0.6364 Remote Similarity NPD3574 Clinical (unspecified phase)
0.6364 Remote Similarity NPD8293 Discontinued
0.6355 Remote Similarity NPD5223 Approved
0.6339 Remote Similarity NPD5955 Clinical (unspecified phase)
0.6337 Remote Similarity NPD5328 Approved
0.6327 Remote Similarity NPD4197 Approved
0.6316 Remote Similarity NPD4632 Approved
0.6311 Remote Similarity NPD7736 Approved
0.6293 Remote Similarity NPD8295 Clinical (unspecified phase)
0.6293 Remote Similarity NPD6009 Approved
0.6286 Remote Similarity NPD5221 Approved
0.6286 Remote Similarity NPD5220 Clinical (unspecified phase)
0.6286 Remote Similarity NPD4697 Phase 3
0.6286 Remote Similarity NPD5222 Approved
0.6283 Remote Similarity NPD6401 Clinical (unspecified phase)
0.6273 Remote Similarity NPD4768 Approved
0.6273 Remote Similarity NPD4767 Approved
0.6263 Remote Similarity NPD5329 Approved
0.625 Remote Similarity NPD4695 Discontinued
0.625 Remote Similarity NPD7604 Phase 2
0.625 Remote Similarity NPD5282 Discontinued
0.6239 Remote Similarity NPD4754 Approved
0.6237 Remote Similarity NPD3703 Phase 2
0.6226 Remote Similarity NPD5173 Approved
0.6226 Remote Similarity NPD6083 Phase 2
0.6226 Remote Similarity NPD6084 Phase 2
0.6218 Remote Similarity NPD5983 Phase 2
0.6214 Remote Similarity NPD8035 Phase 2
0.6214 Remote Similarity NPD8034 Phase 2
0.6214 Remote Similarity NPD6079 Approved
0.6211 Remote Similarity NPD3617 Approved
0.6207 Remote Similarity NPD6274 Approved
0.62 Remote Similarity NPD3618 Phase 1
0.62 Remote Similarity NPD4519 Discontinued
0.62 Remote Similarity NPD4623 Approved
0.62 Remote Similarity NPD6098 Approved
0.619 Remote Similarity NPD5695 Phase 3
0.6179 Remote Similarity NPD6033 Approved
0.6176 Remote Similarity NPD4753 Phase 2
0.6168 Remote Similarity NPD5696 Approved
0.6161 Remote Similarity NPD4729 Approved
0.6161 Remote Similarity NPD5128 Approved
0.6161 Remote Similarity NPD4730 Approved
0.6154 Remote Similarity NPD4202 Approved
0.6154 Remote Similarity NPD7115 Discovery
0.6154 Remote Similarity NPD5778 Approved
0.6154 Remote Similarity NPD5779 Approved
0.6122 Remote Similarity NPD4223 Phase 3
0.6122 Remote Similarity NPD4221 Approved
0.6122 Remote Similarity NPD3667 Approved
0.6111 Remote Similarity NPD7640 Approved
0.6111 Remote Similarity NPD7639 Approved
0.61 Remote Similarity NPD1696 Phase 3
0.61 Remote Similarity NPD7520 Clinical (unspecified phase)
0.6095 Remote Similarity NPD7748 Approved
0.6075 Remote Similarity NPD7902 Approved
0.6071 Remote Similarity NPD5954 Clinical (unspecified phase)
0.6061 Remote Similarity NPD4788 Approved
0.6058 Remote Similarity NPD5693 Phase 1
0.6053 Remote Similarity NPD5249 Phase 3
0.6053 Remote Similarity NPD5248 Approved
0.6053 Remote Similarity NPD5247 Approved
0.6053 Remote Similarity NPD5250 Approved
0.6053 Remote Similarity NPD5251 Approved
0.605 Remote Similarity NPD7101 Approved
0.605 Remote Similarity NPD7100 Approved
0.604 Remote Similarity NPD5690 Phase 2
0.604 Remote Similarity NPD4694 Approved
0.604 Remote Similarity NPD5280 Approved
0.6019 Remote Similarity NPD6904 Approved
0.6019 Remote Similarity NPD6673 Approved
0.6019 Remote Similarity NPD7638 Approved
0.6019 Remote Similarity NPD6080 Approved
0.6017 Remote Similarity NPD6317 Approved
0.6016 Remote Similarity NPD6336 Discontinued
0.6 Remote Similarity NPD5215 Approved
0.6 Remote Similarity NPD5217 Approved
0.6 Remote Similarity NPD5216 Approved
0.6 Remote Similarity NPD7319 Approved
0.6 Remote Similarity NPD4786 Approved
0.6 Remote Similarity NPD6399 Phase 3
0.5966 Remote Similarity NPD6313 Approved
0.5966 Remote Similarity NPD6335 Approved
0.5966 Remote Similarity NPD6314 Approved
0.595 Remote Similarity NPD6909 Approved
0.595 Remote Similarity NPD6908 Approved
0.5934 Remote Similarity NPD5360 Phase 3
0.5934 Remote Similarity NPD5361 Clinical (unspecified phase)
0.5922 Remote Similarity NPD6672 Approved
0.5922 Remote Similarity NPD5737 Approved
0.5913 Remote Similarity NPD5135 Approved
0.5913 Remote Similarity NPD5169 Approved
0.5913 Remote Similarity NPD5134 Clinical (unspecified phase)
0.5905 Remote Similarity NPD6411 Approved
0.5905 Remote Similarity NPD7515 Phase 2
0.5897 Remote Similarity NPD8133 Approved
0.5888 Remote Similarity NPD4629 Approved
0.5888 Remote Similarity NPD5210 Approved
0.5882 Remote Similarity NPD4688 Approved
0.5882 Remote Similarity NPD5205 Approved
0.5882 Remote Similarity NPD4689 Approved
0.5882 Remote Similarity NPD4690 Approved
0.5882 Remote Similarity NPD4693 Phase 3
0.5882 Remote Similarity NPD4138 Approved
0.5872 Remote Similarity NPD4225 Approved
0.5862 Remote Similarity NPD5127 Approved
0.5842 Remote Similarity NPD7338 Clinical (unspecified phase)
0.5842 Remote Similarity NPD3133 Approved
0.5842 Remote Similarity NPD3666 Approved
0.5842 Remote Similarity NPD3665 Phase 1
0.5826 Remote Similarity NPD8132 Clinical (unspecified phase)
0.581 Remote Similarity NPD5692 Phase 3
0.5798 Remote Similarity NPD6868 Approved
0.5794 Remote Similarity NPD7901 Clinical (unspecified phase)
0.5794 Remote Similarity NPD7900 Approved
0.5794 Remote Similarity NPD6001 Approved
0.5789 Remote Similarity NPD6412 Phase 2
0.576 Remote Similarity NPD7507 Approved
0.5755 Remote Similarity NPD7637 Suspended
0.5755 Remote Similarity NPD5694 Approved
0.5755 Remote Similarity NPD6050 Approved
0.5745 Remote Similarity NPD4758 Discontinued
0.5743 Remote Similarity NPD6695 Phase 3
0.5741 Remote Similarity NPD6356 Clinical (unspecified phase)
0.5739 Remote Similarity NPD5168 Approved
0.5728 Remote Similarity NPD5279 Phase 3
0.5714 Remote Similarity NPD7331 Phase 2
0.5714 Remote Similarity NPD5167 Approved
0.5714 Remote Similarity NPD5764 Clinical (unspecified phase)
0.5714 Remote Similarity NPD6101 Approved
0.5714 Remote Similarity NPD7632 Discontinued
0.5714 Remote Similarity NPD7285 Clinical (unspecified phase)
0.5701 Remote Similarity NPD5133 Approved
0.57 Remote Similarity NPD4692 Approved
0.57 Remote Similarity NPD4139 Approved
0.5699 Remote Similarity NPD3700 Clinical (unspecified phase)
0.5699 Remote Similarity NPD3699 Clinical (unspecified phase)
0.5691 Remote Similarity NPD6291 Clinical (unspecified phase)
0.5686 Remote Similarity NPD3668 Phase 3
0.5657 Remote Similarity NPD7645 Phase 2
0.5639 Remote Similarity NPD6334 Approved
0.5639 Remote Similarity NPD6333 Approved
0.5638 Remote Similarity NPD4789 Approved

Structure

External Identifiers

PubChem CID   57396910
ChEMBL   CHEMBL1949797
ZINC  

Physicochemical Properties

Molecular Weight:  250.16
ALogP:  0.6103
MLogP:  2.78
XLogP:  0.717
# Rotatable Bonds:  5
Polar Surface Area:  49.83
# H-Bond Aceptor:  3
# H-Bond Donor:  1
# Rings:  3
# Heavy Atoms:  18

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
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Biological Activities  
Similar NPs/Drugs