Natural Product: NPC214770

Natural Product ID:  NPC214770
Common Name:   Cycloartenone
IUPAC Name:  
Synonyms:   Cycloartenone
Molecular Formula:   C30H48O
Standard InCHIKey:  NAJCQAAOHKVCES-ZZOQNIIDSA-N
Standard InCHI:  InChI=1S/C30H48O/c1-20(2)9-8-10-21(3)22-13-15-28(7)24-12-11-23-26(4,5)25(31)14-16-29(23)19-30(24,29)18-17-27(22,28)6/h9,21-24H,8,10-19H2,1-7H3/t21-,22-,23+,24+,27-,28+,29-,30+/m1/s1
Canonical SMILES:  CC(=CCC[C@H]([C@H]1CC[C@@]2([C@]1(C)CC[C@@]13[C@H]2CC[C@@H]2[C@]3(C1)CCC(=O)C2(C)C)C)C)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
NPO5665 Ulva pertusa Species Ulvaceae Eukaryota HerDing*
NPO28949 Croton cumingii Species Euphorbiaceae Eukaryota UNPD*
NPO17694 Nicotiana tabacum Species Solanaceae Eukaryota TCMID*
NPO10031 Euphorbia antiquorum Species Euphorbiaceae Eukaryota TCMID*
NPO7635 Glycine max Species Fabaceae Eukaryota HerDing*
NPO9052 Pseudocyphellaria norvegica Species Lobariaceae Eukaryota UNPD*
NPO28898 Grewia mollis Species Malvaceae Eukaryota UNPD*
NPO27743 Aaptos aaptos Species Suberitidae Eukaryota UNPD*
NPO9498 Papaver somniferum Species Papaveraceae Eukaryota HerDing*
NPO11422 Aster yunnanensis Species Asteraceae Eukaryota UNPD*
NPO29068 Papilio phorcas Species Papilionidae Eukaryota UNPD*
NPO7676 Caesalpinia japonica Species Fabaceae Eukaryota UNPD*
NPO21552 Oreaster nodosus Species Oreasteridae Eukaryota UNPD*
NPO29510 Aulacocephalus temmincki Species Serranidae Eukaryota UNPD*
NPO29415 Hovenia acerba Species Rhamnaceae Eukaryota UNPD*
NPO29363 Aconitum nevadense Species Ranunculaceae Eukaryota UNPD*
NPO28824 Forsteronia refracta Species Apocynaceae Eukaryota UNPD*
NPO29047 Disynaphia halimifolia Species Asteraceae Eukaryota UNPD*
NPO7956 Discaria chacaye Species Rhamnaceae Eukaryota UNPD*
NPO29314 Mangifera indica Species Anacardiaceae Eukaryota UNPD*
NPO4055 Aspergillus unguis Species Aspergillaceae Eukaryota UNPD*
NPO13818 Narcissus concolor Species Amaryllidaceae Eukaryota UNPD*
NPO3340 Fridericia chica Species Bignoniaceae Eukaryota UNPD*
NPO29292 Teucrium depressum Species Lamiaceae Eukaryota UNPD*
NPO466 Chrysanthemum lacustre Species Asteraceae Eukaryota UNPD*
NPO10828 Adina racemosa Species Rubiaceae Eukaryota UNPD*
NPO29381 Trichilia rubescens Species Meliaceae Eukaryota UNPD*
NPO29276 Juglans nigra Species Juglandaceae Eukaryota UNPD*
NPO29242 Salvia dorrii Species Lamiaceae Eukaryota UNPD*
NPO28784 Alseodaphne corneri Species Lauraceae Eukaryota UNPD*
NPO28845 Eragrostis viscosa Species Poaceae Eukaryota UNPD*
NPO29488 Sophora angustifolia Species Fabaceae Eukaryota UNPD*
NPO29446 Stevia polycephala Species Asteraceae Eukaryota UNPD*
NPO28918 Ophiolepis superba Species Ophiolepididae Eukaryota UNPD*
NPO28864 Nauclea officinalis Species Rubiaceae Eukaryota UNPD*
NPO1459 Euonymus mupinensis Species Celastraceae Eukaryota UNPD*
NPO29225 Oncoba echinata Species Salicaceae Eukaryota UNPD*
NPO10409 Methanothermobacter thermautotrophicus Species Methanobacteriaceae Archaea UNPD*
NPO29189 Castanopsis sclerophylla Species Fagaceae Eukaryota UNPD*
NPO28971 Bersama yangambiensis Species Melianthaceae Eukaryota UNPD*
NPO5447 Digitalis canariensis Species Plantaginaceae Eukaryota UNPD*
NPO27269 Annona impressivenia Species Annonaceae Eukaryota UNPD*
NPO29154 Heliotropium floridum Species Heliotropiaceae Eukaryota UNPD*
NPO29142 Kaunia saltensis Species Asteraceae Eukaryota UNPD*
NPO29530 Kaempferia marginata Species Zingiberaceae Eukaryota UNPD*
NPO25981 Crinipellis scabella Species Marasmiaceae Eukaryota UNPD*
NPO29127 Cystophora scalaris Species Sargassaceae Eukaryota UNPD*
NPO3744 Polycephalomyces nipponicus Species Ophiocordycipitaceae Eukaryota UNPD*
NPO29004 Ruta pinnata Species Rutaceae Eukaryota UNPD*
NPO28937 Heterotheca grandiflora Species Asteraceae Eukaryota UNPD*
NPO29344 Parabenzoin trilobum NA NA NA UNPD*
NPO5681 Acorus gramineus Species Acoraceae Eukaryota TM-MC*
NPO4244 Doodia picta Species Blechnaceae Eukaryota UNPD*
NPO29203 Gymnocarpium robertianum Species Cystopteridaceae Eukaryota UNPD*
NPO8666 Acorus tatarinowii Species Acoraceae Eukaryota TM-MC*
NPO26192 Cordylanthus kingii Species Orobanchaceae Eukaryota UNPD*
NPO29450 Streptomyces parvisporogenes Species Streptomycetaceae Bacteria UNPD*
NPO5665 Ulva pertusa Species Ulvaceae Eukaryota TCMID*
NPO10031 Euphorbia antiquorum Species Euphorbiaceae Eukaryota HerDing*
NPO28805 Thymus piperella Species Lamiaceae Eukaryota UNPD*
NPO9498 Papaver somniferum Species Papaveraceae Eukaryota TCMID*
NPO13272 Ulva lactuca Species Ulvaceae Eukaryota HerDing*
NPO1245 Eunicella cavolinii Species Gorgoniidae Eukaryota UNPD*
NPO13272 Ulva lactuca Species Ulvaceae Eukaryota TCMID*
NPO17694 Nicotiana tabacum Species Solanaceae Eukaryota HerDing*
NPO29400 Conocephalum japonicum Species Conocephalaceae Eukaryota UNPD*
NPO2865 Abrus precatorius Species Fabaceae Eukaryota TCMID*
NPO2865 Abrus precatorius Species Fabaceae Eukaryota HerDing*
NPO4490 Cephalotaxus sinensis Species Taxaceae Eukaryota UNPD*
NPO25443 Citrus reticulata Species Rutaceae Eukaryota TCMID*
NPO30490 Citrus chachiensis Species Rutaceae Eukaryota HerDing*
NPO9157 Rubrivivax gelatinosus Species NA Bacteria UNPD*
NPO7635 Glycine max Species Fabaceae Eukaryota TCMID*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT164 Organism Human herpesvirus 4 Human herpesvirus 4 Inhibition = 2.3 % 17503850
NPT164 Organism Human herpesvirus 4 Human herpesvirus 4 Inhibition = 24.6 % 17503850
NPT164 Organism Human herpesvirus 4 Human herpesvirus 4 Inhibition = 71.3 % 17503850
NPT164 Organism Human herpesvirus 4 Human herpesvirus 4 Inhibition = 92.6 % 17503850
NPT164 Organism Human herpesvirus 4 Human herpesvirus 4 IC50 = 8.8 nM 17503850
NPT80 Cell Line Raji Homo sapiens Activity = 70 % 17503850
NPT2 Others Unspecified Activity = 1.5 17503850

  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 NPC214770 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
1.0 High Similarity NPC477856
0.9394 High Similarity NPC20610
0.9385 High Similarity NPC39462
0.9385 High Similarity NPC189917
0.9385 High Similarity NPC107704
0.9385 High Similarity NPC96812
0.9385 High Similarity NPC168824
0.9254 High Similarity NPC182815
0.9143 High Similarity NPC255650
0.9118 High Similarity NPC159577
0.9118 High Similarity NPC40574
0.9118 High Similarity NPC282593
0.9118 High Similarity NPC35734
0.9014 High Similarity NPC69408
0.9 High Similarity NPC255021
0.8986 High Similarity NPC115023
0.8986 High Similarity NPC470078
0.8971 High Similarity NPC477857
0.8873 High Similarity NPC293803
0.8857 High Similarity NPC251705
0.8857 High Similarity NPC303613
0.8857 High Similarity NPC474228
0.8841 High Similarity NPC307176
0.8806 High Similarity NPC43300
0.8806 High Similarity NPC323005
0.8714 High Similarity NPC234707
0.8696 High Similarity NPC139397
0.863 High Similarity NPC91665
0.8592 High Similarity NPC470044
0.8592 High Similarity NPC470045
0.8571 High Similarity NPC260040
0.8571 High Similarity NPC2634
0.8571 High Similarity NPC265782
0.8571 High Similarity NPC251929
0.8551 High Similarity NPC142754
0.8551 High Similarity NPC82477
0.8551 High Similarity NPC39157
0.8551 High Similarity NPC296697
0.8507 High Similarity NPC469662
0.8472 Intermediate Similarity NPC309852
0.8451 Intermediate Similarity NPC305501
0.8451 Intermediate Similarity NPC54123
0.8429 Intermediate Similarity NPC286814
0.8406 Intermediate Similarity NPC220210
0.8406 Intermediate Similarity NPC20181
0.84 Intermediate Similarity NPC215843
0.8378 Intermediate Similarity NPC470557
0.8358 Intermediate Similarity NPC197238
0.8358 Intermediate Similarity NPC202118
0.8333 Intermediate Similarity NPC181743
0.8333 Intermediate Similarity NPC16287
0.8333 Intermediate Similarity NPC178025
0.8289 Intermediate Similarity NPC474509
0.8267 Intermediate Similarity NPC470052
0.8267 Intermediate Similarity NPC82635
0.8235 Intermediate Similarity NPC285371
0.8228 Intermediate Similarity NPC60350
0.8219 Intermediate Similarity NPC474796
0.8219 Intermediate Similarity NPC474797
0.8219 Intermediate Similarity NPC329866
0.8209 Intermediate Similarity NPC60565
0.8194 Intermediate Similarity NPC190035
0.8194 Intermediate Similarity NPC5701
0.8154 Intermediate Similarity NPC49575
0.8154 Intermediate Similarity NPC230823
0.8154 Intermediate Similarity NPC55004
0.8154 Intermediate Similarity NPC267626
0.8143 Intermediate Similarity NPC176107
0.8108 Intermediate Similarity NPC473171
0.8082 Intermediate Similarity NPC474488
0.8025 Intermediate Similarity NPC476293
0.8 Intermediate Similarity NPC474105
0.8 Intermediate Similarity NPC92327
0.7973 Intermediate Similarity NPC159497
0.7949 Intermediate Similarity NPC147066
0.7945 Intermediate Similarity NPC223187
0.7945 Intermediate Similarity NPC225467
0.7941 Intermediate Similarity NPC213152
0.7922 Intermediate Similarity NPC170793
0.7922 Intermediate Similarity NPC158846
0.7922 Intermediate Similarity NPC90965
0.7848 Intermediate Similarity NPC320514
0.7848 Intermediate Similarity NPC472239
0.7846 Intermediate Similarity NPC184819
0.7826 Intermediate Similarity NPC165695
0.7826 Intermediate Similarity NPC472306
0.7794 Intermediate Similarity NPC25853
0.7794 Intermediate Similarity NPC127582
0.7792 Intermediate Similarity NPC469996
0.7778 Intermediate Similarity NPC310992
0.7778 Intermediate Similarity NPC260474
0.7778 Intermediate Similarity NPC188292
0.7763 Intermediate Similarity NPC469793
0.7763 Intermediate Similarity NPC469796
0.7761 Intermediate Similarity NPC266295
0.7761 Intermediate Similarity NPC30215
0.7761 Intermediate Similarity NPC94991
0.775 Intermediate Similarity NPC21667
0.775 Intermediate Similarity NPC470047
0.775 Intermediate Similarity NPC470046
0.7727 Intermediate Similarity NPC143597
0.7727 Intermediate Similarity NPC151464
0.7722 Intermediate Similarity NPC201912
0.7722 Intermediate Similarity NPC4166
0.7722 Intermediate Similarity NPC38350
0.7714 Intermediate Similarity NPC212210
0.7714 Intermediate Similarity NPC475124
0.7703 Intermediate Similarity NPC181204
0.7692 Intermediate Similarity NPC477371
0.7671 Intermediate Similarity NPC256846
0.7654 Intermediate Similarity NPC59453
0.7654 Intermediate Similarity NPC214043
0.7654 Intermediate Similarity NPC221758
0.7654 Intermediate Similarity NPC85774
0.7654 Intermediate Similarity NPC82902
0.7647 Intermediate Similarity NPC259261
0.7647 Intermediate Similarity NPC23217
0.7647 Intermediate Similarity NPC276764
0.7647 Intermediate Similarity NPC472304
0.7625 Intermediate Similarity NPC311092
0.7625 Intermediate Similarity NPC142253
0.7625 Intermediate Similarity NPC477858
0.7625 Intermediate Similarity NPC3511
0.7625 Intermediate Similarity NPC193347
0.7625 Intermediate Similarity NPC472867
0.7625 Intermediate Similarity NPC260956
0.7595 Intermediate Similarity NPC472478
0.759 Intermediate Similarity NPC93778
0.7576 Intermediate Similarity NPC200258
0.7568 Intermediate Similarity NPC246722
0.7568 Intermediate Similarity NPC151045
0.7564 Intermediate Similarity NPC228911
0.7564 Intermediate Similarity NPC115515
0.7564 Intermediate Similarity NPC63020
0.7561 Intermediate Similarity NPC137493
0.7561 Intermediate Similarity NPC29447
0.7561 Intermediate Similarity NPC470223
0.7561 Intermediate Similarity NPC471224
0.7561 Intermediate Similarity NPC469948
0.7561 Intermediate Similarity NPC474218
0.7558 Intermediate Similarity NPC12722
0.7558 Intermediate Similarity NPC478129
0.7536 Intermediate Similarity NPC270042
0.7534 Intermediate Similarity NPC87141
0.7532 Intermediate Similarity NPC474463
0.7532 Intermediate Similarity NPC20466
0.7531 Intermediate Similarity NPC83569
0.7531 Intermediate Similarity NPC41539
0.7531 Intermediate Similarity NPC167103
0.7531 Intermediate Similarity NPC69279
0.75 Intermediate Similarity NPC477372
0.75 Intermediate Similarity NPC27610
0.75 Intermediate Similarity NPC211641
0.75 Intermediate Similarity NPC193360
0.75 Intermediate Similarity NPC56905
0.75 Intermediate Similarity NPC259252
0.75 Intermediate Similarity NPC176171
0.747 Intermediate Similarity NPC469994
0.747 Intermediate Similarity NPC470051
0.747 Intermediate Similarity NPC474778
0.747 Intermediate Similarity NPC145879
0.747 Intermediate Similarity NPC474733
0.747 Intermediate Similarity NPC31564
0.747 Intermediate Similarity NPC470050
0.747 Intermediate Similarity NPC474732
0.747 Intermediate Similarity NPC51014
0.7468 Intermediate Similarity NPC192744
0.7468 Intermediate Similarity NPC201459
0.7467 Intermediate Similarity NPC304983
0.7465 Intermediate Similarity NPC473902
0.7439 Intermediate Similarity NPC194937
0.7439 Intermediate Similarity NPC476038
0.7439 Intermediate Similarity NPC237712
0.7439 Intermediate Similarity NPC144258
0.7439 Intermediate Similarity NPC87552
0.7439 Intermediate Similarity NPC473246
0.7436 Intermediate Similarity NPC66105
0.7429 Intermediate Similarity NPC475795
0.7424 Intermediate Similarity NPC288296
0.7424 Intermediate Similarity NPC53245
0.7407 Intermediate Similarity NPC100297
0.7407 Intermediate Similarity NPC328351
0.7407 Intermediate Similarity NPC133391
0.7407 Intermediate Similarity NPC469804
0.7407 Intermediate Similarity NPC240302
0.7407 Intermediate Similarity NPC327969
0.7407 Intermediate Similarity NPC469805
0.7407 Intermediate Similarity NPC151519
0.7407 Intermediate Similarity NPC321289
0.7397 Intermediate Similarity NPC193770
0.7397 Intermediate Similarity NPC475523
0.7386 Intermediate Similarity NPC476174
0.7381 Intermediate Similarity NPC475740
0.7381 Intermediate Similarity NPC58063
0.7381 Intermediate Similarity NPC317590
0.7381 Intermediate Similarity NPC136948
0.7381 Intermediate Similarity NPC90652
0.7381 Intermediate Similarity NPC96496
0.7375 Intermediate Similarity NPC267517
0.7368 Intermediate Similarity NPC52667

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC214770 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
0.8841 High Similarity NPD4747 Approved
0.8824 High Similarity NPD3621 Clinical (unspecified phase)
0.8696 High Similarity NPD4137 Phase 3
0.8571 High Similarity NPD4691 Approved
0.8472 Intermediate Similarity NPD5733 Approved
0.8219 Intermediate Similarity NPD4058 Approved
0.8219 Intermediate Similarity NPD4687 Approved
0.8194 Intermediate Similarity NPD5276 Approved
0.7654 Intermediate Similarity NPD4786 Approved
0.7625 Intermediate Similarity NPD4223 Phase 3
0.7625 Intermediate Similarity NPD4221 Approved
0.7561 Intermediate Similarity NPD5329 Approved
0.747 Intermediate Similarity NPD6098 Approved
0.7439 Intermediate Similarity NPD4197 Approved
0.7407 Intermediate Similarity NPD3667 Approved
0.7294 Intermediate Similarity NPD5737 Approved
0.7294 Intermediate Similarity NPD7513 Clinical (unspecified phase)
0.7294 Intermediate Similarity NPD6672 Approved
0.7262 Intermediate Similarity NPD6409 Approved
0.7262 Intermediate Similarity NPD4688 Approved
0.7262 Intermediate Similarity NPD5205 Approved
0.7262 Intermediate Similarity NPD6684 Approved
0.7262 Intermediate Similarity NPD4138 Approved
0.7262 Intermediate Similarity NPD4693 Phase 3
0.7262 Intermediate Similarity NPD4690 Approved
0.7262 Intermediate Similarity NPD5330 Approved
0.7262 Intermediate Similarity NPD7334 Approved
0.7262 Intermediate Similarity NPD4689 Approved
0.7262 Intermediate Similarity NPD7146 Approved
0.7262 Intermediate Similarity NPD7521 Approved
0.7229 Intermediate Similarity NPD3665 Phase 1
0.7229 Intermediate Similarity NPD3668 Phase 3
0.7229 Intermediate Similarity NPD3133 Approved
0.7229 Intermediate Similarity NPD3666 Approved
0.7209 Intermediate Similarity NPD6904 Approved
0.7209 Intermediate Similarity NPD6673 Approved
0.7209 Intermediate Similarity NPD6080 Approved
0.7209 Intermediate Similarity NPD5328 Approved
0.7191 Intermediate Similarity NPD6356 Clinical (unspecified phase)
0.7125 Intermediate Similarity NPD3617 Approved
0.7108 Intermediate Similarity NPD4788 Approved
0.7108 Intermediate Similarity NPD3527 Clinical (unspecified phase)
0.7093 Intermediate Similarity NPD5208 Approved
0.7093 Intermediate Similarity NPD6903 Approved
0.7079 Intermediate Similarity NPD6001 Approved
0.7073 Intermediate Similarity NPD8028 Phase 2
0.7059 Intermediate Similarity NPD3618 Phase 1
0.7059 Intermediate Similarity NPD4694 Approved
0.7059 Intermediate Similarity NPD5690 Phase 2
0.7059 Intermediate Similarity NPD5280 Approved
0.7045 Intermediate Similarity NPD6079 Approved
0.7013 Intermediate Similarity NPD4243 Approved
0.7011 Intermediate Similarity NPD4753 Phase 2
0.7 Intermediate Similarity NPD287 Approved
0.6966 Remote Similarity NPD6399 Phase 3
0.6867 Remote Similarity NPD4139 Approved
0.6867 Remote Similarity NPD4692 Approved
0.686 Remote Similarity NPD3574 Clinical (unspecified phase)
0.686 Remote Similarity NPD5279 Phase 3
0.6854 Remote Similarity NPD6050 Approved
0.6854 Remote Similarity NPD5693 Phase 1
0.6835 Remote Similarity NPD4785 Approved
0.6835 Remote Similarity NPD4784 Approved
0.6829 Remote Similarity NPD4195 Approved
0.6778 Remote Similarity NPD5133 Approved
0.6778 Remote Similarity NPD4202 Approved
0.675 Remote Similarity NPD7339 Approved
0.675 Remote Similarity NPD6942 Approved
0.6747 Remote Similarity NPD4695 Discontinued
0.6744 Remote Similarity NPD7520 Clinical (unspecified phase)
0.6742 Remote Similarity NPD5207 Approved
0.6742 Remote Similarity NPD5692 Phase 3
0.6667 Remote Similarity NPD4623 Approved
0.6667 Remote Similarity NPD6083 Phase 2
0.6667 Remote Similarity NPD6084 Phase 2
0.6667 Remote Similarity NPD5281 Approved
0.6667 Remote Similarity NPD4519 Discontinued
0.6667 Remote Similarity NPD5694 Approved
0.6667 Remote Similarity NPD5284 Approved
0.663 Remote Similarity NPD4629 Approved
0.663 Remote Similarity NPD5210 Approved
0.6623 Remote Similarity NPD5360 Phase 3
0.6623 Remote Similarity NPD5361 Clinical (unspecified phase)
0.6559 Remote Similarity NPD5220 Clinical (unspecified phase)
0.6559 Remote Similarity NPD5222 Approved
0.6559 Remote Similarity NPD4697 Phase 3
0.6559 Remote Similarity NPD5221 Approved
0.6556 Remote Similarity NPD4096 Approved
0.6548 Remote Similarity NPD7525 Registered
0.6543 Remote Similarity NPD4190 Phase 3
0.6543 Remote Similarity NPD5275 Approved
0.6538 Remote Similarity NPD6923 Approved
0.6538 Remote Similarity NPD6922 Approved
0.6522 Remote Similarity NPD5769 Clinical (unspecified phase)
0.6489 Remote Similarity NPD5173 Approved
0.6489 Remote Similarity NPD4755 Approved
0.6489 Remote Similarity NPD5959 Approved
0.6484 Remote Similarity NPD7515 Phase 2
0.6456 Remote Similarity NPD7143 Approved
0.6456 Remote Similarity NPD4789 Approved
0.6456 Remote Similarity NPD7144 Approved
0.6456 Remote Similarity NPD6938 Clinical (unspecified phase)
0.6456 Remote Similarity NPD6939 Phase 2
0.6452 Remote Similarity NPD5695 Phase 3
0.6444 Remote Similarity NPD7285 Clinical (unspecified phase)
0.6421 Remote Similarity NPD5696 Approved
0.6404 Remote Similarity NPD3573 Approved
0.6375 Remote Similarity NPD7150 Approved
0.6375 Remote Similarity NPD6081 Approved
0.6375 Remote Similarity NPD4809 Clinical (unspecified phase)
0.6375 Remote Similarity NPD4808 Clinical (unspecified phase)
0.6375 Remote Similarity NPD7152 Approved
0.6375 Remote Similarity NPD7151 Approved
0.6364 Remote Similarity NPD4224 Phase 2
0.6354 Remote Similarity NPD4700 Approved
0.6354 Remote Similarity NPD5286 Approved
0.6354 Remote Similarity NPD5285 Approved
0.6354 Remote Similarity NPD4696 Approved
0.6344 Remote Similarity NPD7901 Clinical (unspecified phase)
0.6344 Remote Similarity NPD7748 Approved
0.6344 Remote Similarity NPD7900 Approved
0.6333 Remote Similarity NPD4518 Approved
0.6327 Remote Similarity NPD6052 Approved
0.631 Remote Similarity NPD5784 Clinical (unspecified phase)
0.6304 Remote Similarity NPD8034 Phase 2
0.6304 Remote Similarity NPD8035 Phase 2
0.6289 Remote Similarity NPD5223 Approved
0.6277 Remote Similarity NPD5654 Approved
0.6265 Remote Similarity NPD3701 Clinical (unspecified phase)
0.625 Remote Similarity NPD4244 Approved
0.625 Remote Similarity NPD4245 Approved
0.6234 Remote Similarity NPD3171 Clinical (unspecified phase)
0.6224 Remote Similarity NPD5224 Approved
0.6224 Remote Similarity NPD5226 Approved
0.6224 Remote Similarity NPD5211 Phase 2
0.6224 Remote Similarity NPD5225 Approved
0.6224 Remote Similarity NPD5091 Approved
0.6224 Remote Similarity NPD4633 Approved
0.622 Remote Similarity NPD6924 Approved
0.622 Remote Similarity NPD6926 Approved
0.6207 Remote Similarity NPD4752 Clinical (unspecified phase)
0.62 Remote Similarity NPD6008 Approved
0.62 Remote Similarity NPD5739 Approved
0.62 Remote Similarity NPD6402 Approved
0.62 Remote Similarity NPD7128 Approved
0.62 Remote Similarity NPD6675 Approved
0.6173 Remote Similarity NPD4758 Discontinued
0.6173 Remote Similarity NPD5777 Approved
0.6162 Remote Similarity NPD5175 Approved
0.6162 Remote Similarity NPD5174 Approved
0.6162 Remote Similarity NPD4754 Approved
0.6146 Remote Similarity NPD7902 Approved
0.6139 Remote Similarity NPD6614 Approved
0.6125 Remote Similarity NPD3700 Clinical (unspecified phase)
0.6125 Remote Similarity NPD3699 Clinical (unspecified phase)
0.6125 Remote Similarity NPD3698 Phase 2
0.6119 Remote Similarity NPD345 Approved
0.6119 Remote Similarity NPD344 Approved
0.6119 Remote Similarity NPD343 Approved
0.61 Remote Similarity NPD5141 Approved
0.6092 Remote Similarity NPD6902 Approved
0.6087 Remote Similarity NPD6051 Approved
0.6082 Remote Similarity NPD7638 Approved
0.6078 Remote Similarity NPD6899 Approved
0.6078 Remote Similarity NPD7320 Approved
0.6078 Remote Similarity NPD6881 Approved
0.6071 Remote Similarity NPD6933 Approved
0.6042 Remote Similarity NPD7614 Phase 1
0.6042 Remote Similarity NPD7732 Phase 3
0.604 Remote Similarity NPD4767 Approved
0.604 Remote Similarity NPD4768 Approved
0.6024 Remote Similarity NPD6113 Clinical (unspecified phase)
0.602 Remote Similarity NPD7639 Approved
0.602 Remote Similarity NPD6404 Discontinued
0.602 Remote Similarity NPD7640 Approved
0.6019 Remote Similarity NPD6372 Approved
0.6019 Remote Similarity NPD6373 Approved
0.6 Remote Similarity NPD6925 Approved
0.6 Remote Similarity NPD6932 Approved
0.6 Remote Similarity NPD5776 Phase 2
0.598 Remote Similarity NPD6412 Phase 2
0.598 Remote Similarity NPD5701 Approved
0.598 Remote Similarity NPD5697 Approved
0.5962 Remote Similarity NPD7102 Approved
0.5962 Remote Similarity NPD7290 Approved
0.5962 Remote Similarity NPD6883 Approved
0.5949 Remote Similarity NPD7331 Phase 2
0.593 Remote Similarity NPD7145 Approved
0.593 Remote Similarity NPD5364 Discontinued
0.5922 Remote Similarity NPD6011 Approved
0.5922 Remote Similarity NPD4729 Approved
0.5922 Remote Similarity NPD4730 Approved
0.5922 Remote Similarity NPD5168 Approved
0.5922 Remote Similarity NPD5128 Approved
0.5905 Remote Similarity NPD6650 Approved
0.5905 Remote Similarity NPD6617 Approved
0.5905 Remote Similarity NPD6401 Clinical (unspecified phase)
0.5905 Remote Similarity NPD6869 Approved
0.5905 Remote Similarity NPD6847 Approved
0.5905 Remote Similarity NPD8130 Phase 1

Structure

External Identifiers

PubChem CID   12305360
ChEMBL   CHEMBL226084
ZINC  

Physicochemical Properties

Molecular Weight:  424.37
ALogP:  3.8673
MLogP:  4.65
XLogP:  11.314
# Rotatable Bonds:  11
Polar Surface Area:  17.07
# H-Bond Aceptor:  1
# H-Bond Donor:  0
# Rings:  5
# Heavy Atoms:  31

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