Natural Product: NPC233780

Natural Product ID:  NPC233780
Common Name:   6,7-Dimethoxy-3H-2-Benzofuran-1-One
IUPAC Name:   6,7-dimethoxy-3H-2-benzofuran-1-one
Synonyms:  
Molecular Formula:   C10H10O4
Standard InCHIKey:  ORFFGRQMMWVHIB-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C10H10O4/c1-12-7-4-3-6-5-14-10(11)8(6)9(7)13-2/h3-4H,5H2,1-2H3
Canonical SMILES:  COc1c(OC)ccc2c1C(=O)OC2
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
NPO31048 Papaver sommiferum Species Papaveraceae Eukaryota TCM_Taiwan*
NPO7312 Aplidium multiplicatum Species Polyclinidae Eukaryota UNPD*
NPO9498 Papaver somniferum Species Papaveraceae Eukaryota UNPD*
NPO10176 Chrozophora prostrata Species Euphorbiaceae Eukaryota UNPD*
NPO2466 Aloe microstigma Species Asphodelaceae Eukaryota UNPD*
NPO9498 Papaver somniferum Species Papaveraceae Eukaryota TCMID*
NPO18366 Papaver commutatum Species Papaveraceae Eukaryota TCMID*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT483 Individual Protein Prelamin-A/C Homo sapiens Potency = 70.8 nM PubChem BioAssay data set
NPT48 Individual Protein Lysine-specific demethylase 4D-like Homo sapiens Potency = 31622.8 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 35481.3 nM PubChem BioAssay data set
NPT5 Individual Protein Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 Homo sapiens Potency 28183.8 nM PubChem BioAssay data set
NPT6 Organism Plasmodium falciparum Plasmodium falciparum Potency 23.3 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 6513.1 nM PubChem BioAssay data set
NPT8 Individual Protein DNA polymerase iota Homo sapiens Potency 70794.6 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 11220.2 nM PubChem BioAssay data set
NPT6 Organism Plasmodium falciparum Plasmodium falciparum Potency 13115.4 nM PubChem BioAssay data set
NPT11 Individual Protein Guanine nucleotide-binding protein G(s), subunit alpha Homo sapiens Potency 35481.3 nM PubChem BioAssay data set
NPT920 Individual Protein Alpha-synuclein Homo sapiens Potency 31622.8 nM PubChem BioAssay data set

  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 NPC233780 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
0.9847 High Similarity NPC160425
0.9424 High Similarity NPC32058
0.9424 High Similarity NPC85734
0.942 High Similarity NPC27106
0.9348 High Similarity NPC258307
0.9028 High Similarity NPC96501
0.8966 High Similarity NPC473732
0.8904 High Similarity NPC475116
0.8851 High Similarity NPC301897
0.8849 High Similarity NPC46947
0.8794 High Similarity NPC90411
0.8784 High Similarity NPC79998
0.8784 High Similarity NPC199926
0.8741 High Similarity NPC470932
0.8725 High Similarity NPC150227
0.8676 High Similarity NPC473271
0.8675 High Similarity NPC78944
0.8667 High Similarity NPC190020
0.8667 High Similarity NPC84935
0.8667 High Similarity NPC77679
0.8657 High Similarity NPC154275
0.8649 High Similarity NPC295646
0.8633 High Similarity NPC470844
0.8623 High Similarity NPC288743
0.8618 High Similarity NPC15212
0.8611 High Similarity NPC184702
0.8601 High Similarity NPC297985
0.8591 High Similarity NPC281477
0.8581 High Similarity NPC240768
0.8581 High Similarity NPC200773
0.8571 High Similarity NPC209229
0.8553 High Similarity NPC200594
0.854 High Similarity NPC299010
0.8533 High Similarity NPC82592
0.8533 High Similarity NPC16082
0.8511 High Similarity NPC135837
0.8511 High Similarity NPC474274
0.8511 High Similarity NPC157944
0.8511 High Similarity NPC62907
0.85 High Similarity NPC143649
0.8477 Intermediate Similarity NPC115123
0.8477 Intermediate Similarity NPC227062
0.8477 Intermediate Similarity NPC239113
0.844 Intermediate Similarity NPC77955
0.8431 Intermediate Similarity NPC47623
0.8429 Intermediate Similarity NPC311339
0.8425 Intermediate Similarity NPC224687
0.8421 Intermediate Similarity NPC143328
0.8421 Intermediate Similarity NPC19600
0.8406 Intermediate Similarity NPC285776
0.8392 Intermediate Similarity NPC134969
0.8392 Intermediate Similarity NPC471819
0.8389 Intermediate Similarity NPC179178
0.838 Intermediate Similarity NPC14022
0.837 Intermediate Similarity NPC470162
0.837 Intermediate Similarity NPC470163
0.8369 Intermediate Similarity NPC180905
0.8369 Intermediate Similarity NPC182496
0.8369 Intermediate Similarity NPC211386
0.8367 Intermediate Similarity NPC153620
0.8367 Intermediate Similarity NPC24257
0.8356 Intermediate Similarity NPC280404
0.8356 Intermediate Similarity NPC277426
0.8356 Intermediate Similarity NPC213900
0.8356 Intermediate Similarity NPC210425
0.8356 Intermediate Similarity NPC86373
0.8356 Intermediate Similarity NPC23955
0.8355 Intermediate Similarity NPC54928
0.8355 Intermediate Similarity NPC474983
0.8345 Intermediate Similarity NPC474385
0.8344 Intermediate Similarity NPC186507
0.8333 Intermediate Similarity NPC70016
0.8333 Intermediate Similarity NPC215921
0.8333 Intermediate Similarity NPC51681
0.8333 Intermediate Similarity NPC204350
0.8323 Intermediate Similarity NPC144843
0.8323 Intermediate Similarity NPC22324
0.8322 Intermediate Similarity NPC44573
0.8322 Intermediate Similarity NPC197666
0.8322 Intermediate Similarity NPC126739
0.8311 Intermediate Similarity NPC474999
0.8311 Intermediate Similarity NPC117463
0.8299 Intermediate Similarity NPC474446
0.8299 Intermediate Similarity NPC296575
0.8299 Intermediate Similarity NPC30890
0.8299 Intermediate Similarity NPC136278
0.8299 Intermediate Similarity NPC213482
0.8298 Intermediate Similarity NPC155098
0.8298 Intermediate Similarity NPC37065
0.8289 Intermediate Similarity NPC16286
0.8289 Intermediate Similarity NPC38898
0.8288 Intermediate Similarity NPC18211
0.8288 Intermediate Similarity NPC472006
0.8288 Intermediate Similarity NPC474036
0.8288 Intermediate Similarity NPC70853
0.8288 Intermediate Similarity NPC51106
0.8288 Intermediate Similarity NPC9966
0.8278 Intermediate Similarity NPC308555
0.8278 Intermediate Similarity NPC271681
0.8278 Intermediate Similarity NPC148497
0.8278 Intermediate Similarity NPC292460
0.8278 Intermediate Similarity NPC153008
0.8278 Intermediate Similarity NPC199773
0.8276 Intermediate Similarity NPC58229
0.8276 Intermediate Similarity NPC475730
0.8276 Intermediate Similarity NPC1704
0.8276 Intermediate Similarity NPC130485
0.8276 Intermediate Similarity NPC67650
0.8267 Intermediate Similarity NPC469619
0.8267 Intermediate Similarity NPC119929
0.8267 Intermediate Similarity NPC31132
0.8267 Intermediate Similarity NPC216917
0.8267 Intermediate Similarity NPC469670
0.8264 Intermediate Similarity NPC275356
0.8255 Intermediate Similarity NPC476058
0.8247 Intermediate Similarity NPC325122
0.8243 Intermediate Similarity NPC231013
0.8243 Intermediate Similarity NPC110639
0.8243 Intermediate Similarity NPC472033
0.8243 Intermediate Similarity NPC138978
0.8243 Intermediate Similarity NPC14958
0.8243 Intermediate Similarity NPC120924
0.8243 Intermediate Similarity NPC195919
0.8243 Intermediate Similarity NPC40818
0.8243 Intermediate Similarity NPC260946
0.8243 Intermediate Similarity NPC106461
0.8243 Intermediate Similarity NPC107625
0.8243 Intermediate Similarity NPC215932
0.8243 Intermediate Similarity NPC216314
0.8239 Intermediate Similarity NPC72796
0.8239 Intermediate Similarity NPC44245
0.8235 Intermediate Similarity NPC197751
0.8231 Intermediate Similarity NPC293201
0.8231 Intermediate Similarity NPC113089
0.8227 Intermediate Similarity NPC159418
0.8227 Intermediate Similarity NPC283823
0.8227 Intermediate Similarity NPC153783
0.8224 Intermediate Similarity NPC478213
0.8224 Intermediate Similarity NPC244371
0.8219 Intermediate Similarity NPC214919
0.8219 Intermediate Similarity NPC299154
0.8219 Intermediate Similarity NPC471644
0.8219 Intermediate Similarity NPC29536
0.8219 Intermediate Similarity NPC185607
0.8219 Intermediate Similarity NPC469579
0.8219 Intermediate Similarity NPC471640
0.8219 Intermediate Similarity NPC124467
0.8217 Intermediate Similarity NPC191930
0.8217 Intermediate Similarity NPC474301
0.8214 Intermediate Similarity NPC7012
0.8212 Intermediate Similarity NPC472535
0.8212 Intermediate Similarity NPC228662
0.8212 Intermediate Similarity NPC474388
0.8212 Intermediate Similarity NPC104353
0.8212 Intermediate Similarity NPC118332
0.8212 Intermediate Similarity NPC474170
0.8207 Intermediate Similarity NPC50823
0.8205 Intermediate Similarity NPC116838
0.8205 Intermediate Similarity NPC61141
0.8205 Intermediate Similarity NPC22130
0.8201 Intermediate Similarity NPC153547
0.82 Intermediate Similarity NPC300983
0.82 Intermediate Similarity NPC474648
0.82 Intermediate Similarity NPC238366
0.8194 Intermediate Similarity NPC470962
0.8188 Intermediate Similarity NPC472036
0.8188 Intermediate Similarity NPC166583
0.8188 Intermediate Similarity NPC470511
0.8188 Intermediate Similarity NPC205522
0.8188 Intermediate Similarity NPC85233
0.8188 Intermediate Similarity NPC223807
0.8188 Intermediate Similarity NPC210320
0.8188 Intermediate Similarity NPC53362
0.8188 Intermediate Similarity NPC52106
0.8188 Intermediate Similarity NPC137296
0.8182 Intermediate Similarity NPC326847
0.8182 Intermediate Similarity NPC217423
0.8182 Intermediate Similarity NPC473395
0.8182 Intermediate Similarity NPC258644
0.8176 Intermediate Similarity NPC471590
0.8176 Intermediate Similarity NPC472917
0.8176 Intermediate Similarity NPC75694
0.8176 Intermediate Similarity NPC472034
0.817 Intermediate Similarity NPC471800
0.817 Intermediate Similarity NPC254163
0.817 Intermediate Similarity NPC20541
0.817 Intermediate Similarity NPC122623
0.817 Intermediate Similarity NPC276059
0.817 Intermediate Similarity NPC471746
0.817 Intermediate Similarity NPC34725
0.817 Intermediate Similarity NPC241774
0.8169 Intermediate Similarity NPC45404
0.8163 Intermediate Similarity NPC471639
0.8163 Intermediate Similarity NPC15743
0.8163 Intermediate Similarity NPC143092
0.8163 Intermediate Similarity NPC469542
0.8163 Intermediate Similarity NPC471643
0.8163 Intermediate Similarity NPC27159
0.8158 Intermediate Similarity NPC68882
0.8158 Intermediate Similarity NPC180388

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC233780 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
0.8489 Intermediate Similarity NPD447 Suspended
0.8264 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.8176 Intermediate Similarity NPD2534 Approved
0.8176 Intermediate Similarity NPD2533 Approved
0.8176 Intermediate Similarity NPD2532 Approved
0.817 Intermediate Similarity NPD3817 Phase 2
0.8129 Intermediate Similarity NPD919 Approved
0.8089 Intermediate Similarity NPD6232 Discontinued
0.8077 Intermediate Similarity NPD5494 Approved
0.8 Intermediate Similarity NPD3882 Suspended
0.7972 Intermediate Similarity NPD1933 Approved
0.7937 Intermediate Similarity NPD7473 Discontinued
0.7922 Intermediate Similarity NPD1934 Approved
0.7911 Intermediate Similarity NPD1247 Approved
0.7883 Intermediate Similarity NPD3705 Approved
0.7871 Intermediate Similarity NPD2801 Approved
0.7857 Intermediate Similarity NPD1019 Discontinued
0.7847 Intermediate Similarity NPD230 Phase 1
0.7847 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7829 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7829 Intermediate Similarity NPD920 Approved
0.7756 Intermediate Similarity NPD7819 Suspended
0.7755 Intermediate Similarity NPD2935 Discontinued
0.7748 Intermediate Similarity NPD1511 Approved
0.7748 Intermediate Similarity NPD6799 Approved
0.7746 Intermediate Similarity NPD6832 Phase 2
0.7702 Intermediate Similarity NPD3926 Phase 2
0.7698 Intermediate Similarity NPD9717 Approved
0.7697 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7692 Intermediate Similarity NPD37 Approved
0.7687 Intermediate Similarity NPD3748 Approved
0.7669 Intermediate Similarity NPD3818 Discontinued
0.7658 Intermediate Similarity NPD4965 Approved
0.7658 Intermediate Similarity NPD4967 Phase 2
0.7658 Intermediate Similarity NPD4966 Approved
0.7647 Intermediate Similarity NPD1512 Approved
0.7643 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.7643 Intermediate Similarity NPD1465 Phase 2
0.7632 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7628 Intermediate Similarity NPD6385 Approved
0.7628 Intermediate Similarity NPD6386 Approved
0.7622 Intermediate Similarity NPD5844 Phase 1
0.76 Intermediate Similarity NPD1243 Approved
0.7584 Intermediate Similarity NPD2346 Discontinued
0.7566 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7564 Intermediate Similarity NPD6599 Discontinued
0.7562 Intermediate Similarity NPD6234 Discontinued
0.7552 Intermediate Similarity NPD9494 Approved
0.755 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.7547 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7536 Intermediate Similarity NPD5691 Approved
0.7517 Intermediate Similarity NPD1551 Phase 2
0.7517 Intermediate Similarity NPD2796 Approved
0.7517 Intermediate Similarity NPD411 Approved
0.75 Intermediate Similarity NPD3226 Approved
0.7486 Intermediate Similarity NPD4420 Approved
0.7485 Intermediate Similarity NPD5242 Approved
0.7484 Intermediate Similarity NPD5353 Approved
0.7484 Intermediate Similarity NPD5402 Approved
0.7469 Intermediate Similarity NPD7199 Phase 2
0.745 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.745 Intermediate Similarity NPD2799 Discontinued
0.745 Intermediate Similarity NPD1510 Phase 2
0.7445 Intermediate Similarity NPD9493 Approved
0.744 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7439 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.7439 Intermediate Similarity NPD6166 Phase 2
0.7439 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.7434 Intermediate Similarity NPD3750 Approved
0.7423 Intermediate Similarity NPD5711 Approved
0.7423 Intermediate Similarity NPD5710 Approved
0.7421 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7415 Intermediate Similarity NPD1240 Approved
0.7413 Intermediate Similarity NPD1203 Approved
0.741 Intermediate Similarity NPD7054 Approved
0.7397 Intermediate Similarity NPD1699 Clinical (unspecified phase)
0.7397 Intermediate Similarity NPD3764 Approved
0.7391 Intermediate Similarity NPD3749 Approved
0.7384 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.7378 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7376 Intermediate Similarity NPD1281 Approved
0.7365 Intermediate Similarity NPD7074 Phase 3
0.7365 Intermediate Similarity NPD7472 Approved
0.7357 Intermediate Similarity NPD17 Approved
0.7355 Intermediate Similarity NPD5401 Approved
0.7351 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.7351 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.7338 Intermediate Similarity NPD9545 Approved
0.732 Intermediate Similarity NPD4628 Phase 3
0.7318 Intermediate Similarity NPD5006 Approved
0.7318 Intermediate Similarity NPD5005 Approved
0.7315 Intermediate Similarity NPD1607 Approved
0.7303 Intermediate Similarity NPD1549 Phase 2
0.7297 Intermediate Similarity NPD2979 Phase 3
0.7293 Intermediate Similarity NPD1358 Approved
0.7285 Intermediate Similarity NPD2438 Suspended
0.7284 Intermediate Similarity NPD7075 Discontinued
0.7279 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7279 Intermediate Similarity NPD2313 Discontinued
0.7266 Intermediate Similarity NPD5536 Phase 2
0.7261 Intermediate Similarity NPD5403 Approved
0.7255 Intermediate Similarity NPD2800 Approved
0.7255 Intermediate Similarity NPD2654 Approved
0.7254 Intermediate Similarity NPD1547 Clinical (unspecified phase)
0.725 Intermediate Similarity NPD6801 Discontinued
0.7246 Intermediate Similarity NPD7228 Approved
0.7244 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.7244 Intermediate Similarity NPD3146 Approved
0.7244 Intermediate Similarity NPD3688 Clinical (unspecified phase)
0.7237 Intermediate Similarity NPD1471 Phase 3
0.7235 Intermediate Similarity NPD7808 Phase 3
0.7234 Intermediate Similarity NPD4626 Approved
0.7233 Intermediate Similarity NPD4380 Phase 2
0.7226 Intermediate Similarity NPD1241 Discontinued
0.7222 Intermediate Similarity NPD1876 Approved
0.7222 Intermediate Similarity NPD7768 Phase 2
0.7222 Intermediate Similarity NPD1283 Approved
0.7219 Intermediate Similarity NPD6797 Phase 2
0.7208 Intermediate Similarity NPD4109 Clinical (unspecified phase)
0.7208 Intermediate Similarity NPD4110 Phase 3
0.7203 Intermediate Similarity NPD1608 Approved
0.7197 Intermediate Similarity NPD1940 Clinical (unspecified phase)
0.7188 Intermediate Similarity NPD7411 Suspended
0.7181 Intermediate Similarity NPD943 Approved
0.7176 Intermediate Similarity NPD7251 Discontinued
0.7176 Intermediate Similarity NPD6559 Discontinued
0.7163 Intermediate Similarity NPD9268 Approved
0.7162 Intermediate Similarity NPD1296 Phase 2
0.7152 Intermediate Similarity NPD8127 Discontinued
0.7143 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7133 Intermediate Similarity NPD6355 Discontinued
0.7132 Intermediate Similarity NPD2181 Clinical (unspecified phase)
0.7124 Intermediate Similarity NPD2344 Approved
0.7124 Intermediate Similarity NPD2343 Clinical (unspecified phase)
0.7123 Intermediate Similarity NPD2798 Approved
0.7121 Intermediate Similarity NPD9261 Approved
0.7113 Intermediate Similarity NPD1778 Approved
0.7111 Intermediate Similarity NPD2182 Approved
0.711 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.7101 Intermediate Similarity NPD5283 Phase 1
0.7099 Intermediate Similarity NPD1006 Clinical (unspecified phase)
0.7083 Intermediate Similarity NPD9269 Phase 2
0.7076 Intermediate Similarity NPD7240 Approved
0.7076 Intermediate Similarity NPD7685 Pre-registration
0.7073 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.7068 Intermediate Similarity NPD164 Approved
0.7067 Intermediate Similarity NPD4307 Phase 2
0.7063 Intermediate Similarity NPD3496 Discontinued
0.7055 Intermediate Similarity NPD3267 Approved
0.7055 Intermediate Similarity NPD3266 Approved
0.7048 Intermediate Similarity NPD6959 Discontinued
0.7042 Intermediate Similarity NPD1651 Approved
0.7024 Intermediate Similarity NPD2403 Approved
0.7018 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7014 Intermediate Similarity NPD422 Phase 1
0.7013 Intermediate Similarity NPD6003 Clinical (unspecified phase)
0.7013 Intermediate Similarity NPD6005 Phase 3
0.7013 Intermediate Similarity NPD6004 Phase 3
0.7013 Intermediate Similarity NPD6002 Phase 3
0.7013 Intermediate Similarity NPD6006 Clinical (unspecified phase)
0.7006 Intermediate Similarity NPD7229 Phase 3
0.7006 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD1653 Approved
0.6994 Remote Similarity NPD8313 Approved
0.6994 Remote Similarity NPD8312 Approved
0.6981 Remote Similarity NPD6273 Approved
0.698 Remote Similarity NPD3027 Phase 3
0.6975 Remote Similarity NPD6873 Phase 2
0.6963 Remote Similarity NPD3134 Approved
0.6959 Remote Similarity NPD3018 Phase 2
0.6957 Remote Similarity NPD5808 Clinical (unspecified phase)
0.6957 Remote Similarity NPD228 Approved
0.6954 Remote Similarity NPD1613 Approved
0.6954 Remote Similarity NPD1612 Clinical (unspecified phase)
0.6954 Remote Similarity NPD4060 Phase 1
0.6951 Remote Similarity NPD8443 Clinical (unspecified phase)
0.695 Remote Similarity NPD405 Clinical (unspecified phase)
0.6948 Remote Similarity NPD5404 Approved
0.6948 Remote Similarity NPD5405 Approved
0.6948 Remote Similarity NPD5406 Approved
0.6948 Remote Similarity NPD2531 Phase 2
0.6948 Remote Similarity NPD5408 Approved
0.6943 Remote Similarity NPD6190 Approved
0.6943 Remote Similarity NPD2309 Approved
0.6941 Remote Similarity NPD3751 Discontinued
0.6941 Remote Similarity NPD7893 Clinical (unspecified phase)
0.6939 Remote Similarity NPD2797 Approved
0.6939 Remote Similarity NPD1470 Approved
0.6933 Remote Similarity NPD6798 Discontinued
0.6928 Remote Similarity NPD5537 Clinical (unspecified phase)
0.6923 Remote Similarity NPD7852 Clinical (unspecified phase)
0.6923 Remote Similarity NPD5585 Approved
0.6918 Remote Similarity NPD7004 Clinical (unspecified phase)
0.6918 Remote Similarity NPD7422 Clinical (unspecified phase)
0.6918 Remote Similarity NPD4379 Clinical (unspecified phase)
0.6913 Remote Similarity NPD1529 Clinical (unspecified phase)
0.6913 Remote Similarity NPD1008 Clinical (unspecified phase)
0.6912 Remote Similarity NPD9264 Approved
0.6912 Remote Similarity NPD9263 Approved
0.6912 Remote Similarity NPD9267 Approved

Structure

External Identifiers

PubChem CID   68437
ChEMBL   CHEMBL1333869
ZINC  

Physicochemical Properties

Molecular Weight:  194.06
ALogP:  -0.1831
MLogP:  2.12
XLogP:  1.499
# Rotatable Bonds:  4
Polar Surface Area:  44.76
# H-Bond Aceptor:  2
# H-Bond Donor:  0
# Rings:  2
# Heavy Atoms:  14

Download Data

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Biological Activities  
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