Natural Product: NPC325646

Natural Product ID:  NPC325646
Common Name:   Dalbergione, 4-Methoxy-4'-Hydroxy-
IUPAC Name:   2-[1-(4-hydroxyphenyl)prop-2-enyl]-5-methoxycyclohexa-2,5-diene-1,4-dione
Synonyms:  
Molecular Formula:   C16H14O4
Standard InCHIKey:  DLCVFIMWFKVRTM-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C16H14O4/c1-3-12(10-4-6-11(17)7-5-10)13-8-15(19)16(20-2)9-14(13)18/h3-9,12,17H,1H2,2H3
Canonical SMILES:  COC1=CC(=O)C(=CC1=O)C(c1ccc(cc1)O)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
NPO18117 Dalbergia odorifera Species Fabaceae Eukaryota TCM_Taiwan*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT48 Individual Protein Lysine-specific demethylase 4D-like Homo sapiens Potency = 12589.3 nM PubChem BioAssay data set
NPT51 Individual Protein Microtubule-associated protein tau Homo sapiens Potency = 25118.9 nM PubChem BioAssay data set
NPT51 Individual Protein Microtubule-associated protein tau Homo sapiens Potency = 31622.8 nM PubChem BioAssay data set
NPT792 Individual Protein Arachidonate 15-lipoxygenase Homo sapiens Potency = 25118.9 nM PubChem BioAssay data set
NPT51 Individual Protein Microtubule-associated protein tau Homo sapiens Potency = 39810.7 nM PubChem BioAssay data set
NPT55 Individual Protein Putative fructose-1,6-bisphosphate aldolase Giardia intestinalis Potency = 15811.4 nM PubChem BioAssay data set
NPT109 Individual Protein Cytochrome P450 3A4 Homo sapiens Potency = 25118.9 nM PubChem BioAssay data set
NPT1139 Individual Protein Arachidonate 15-lipoxygenase, type II Homo sapiens Potency 19952.6 nM PubChem BioAssay data set
NPT444 Individual Protein Ubiquitin carboxyl-terminal hydrolase 1 Homo sapiens Potency 25118.9 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 29092.9 nM PubChem BioAssay data set
NPT73 Individual Protein Solute carrier organic anion transporter family member 1B1 Homo sapiens Inhibition = 114.14 % 23571415
NPT72 Individual Protein Solute carrier organic anion transporter family member 1B3 Homo sapiens Inhibition = 246.58 % 23571415
NPT2 Others Unspecified Potency 14125.4 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 NPC325646 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 NPC28951
0.906 High Similarity NPC164947
0.8908 High Similarity NPC474766
0.875 High Similarity NPC21162
0.8696 High Similarity NPC23402
0.8684 High Similarity NPC11824
0.8673 High Similarity NPC470355
0.8667 High Similarity NPC135062
0.8661 High Similarity NPC88141
0.864 High Similarity NPC239302
0.8595 High Similarity NPC474803
0.8583 High Similarity NPC139171
0.8559 High Similarity NPC29989
0.8559 High Similarity NPC70843
0.8559 High Similarity NPC95178
0.8559 High Similarity NPC69332
0.8534 High Similarity NPC322197
0.848 Intermediate Similarity NPC27659
0.848 Intermediate Similarity NPC172673
0.8462 Intermediate Similarity NPC19290
0.8448 Intermediate Similarity NPC285350
0.8426 Intermediate Similarity NPC260000
0.8421 Intermediate Similarity NPC222905
0.8393 Intermediate Similarity NPC188677
0.8378 Intermediate Similarity NPC120693
0.8378 Intermediate Similarity NPC261573
0.8378 Intermediate Similarity NPC8931
0.8349 Intermediate Similarity NPC280869
0.8348 Intermediate Similarity NPC212718
0.8333 Intermediate Similarity NPC95172
0.832 Intermediate Similarity NPC469930
0.8319 Intermediate Similarity NPC228737
0.8319 Intermediate Similarity NPC226699
0.8306 Intermediate Similarity NPC51037
0.8304 Intermediate Similarity NPC13495
0.8288 Intermediate Similarity NPC135784
0.8276 Intermediate Similarity NPC48525
0.8257 Intermediate Similarity NPC145052
0.8246 Intermediate Similarity NPC317305
0.823 Intermediate Similarity NPC6984
0.8226 Intermediate Similarity NPC137416
0.8211 Intermediate Similarity NPC14141
0.8198 Intermediate Similarity NPC472585
0.819 Intermediate Similarity NPC177576
0.8189 Intermediate Similarity NPC253488
0.8182 Intermediate Similarity NPC473136
0.8175 Intermediate Similarity NPC201419
0.8175 Intermediate Similarity NPC237225
0.8175 Intermediate Similarity NPC165257
0.816 Intermediate Similarity NPC15837
0.8158 Intermediate Similarity NPC34715
0.8151 Intermediate Similarity NPC299252
0.8151 Intermediate Similarity NPC277394
0.8151 Intermediate Similarity NPC61062
0.8145 Intermediate Similarity NPC164014
0.814 Intermediate Similarity NPC327410
0.8125 Intermediate Similarity NPC68269
0.812 Intermediate Similarity NPC17693
0.812 Intermediate Similarity NPC286222
0.812 Intermediate Similarity NPC231717
0.8115 Intermediate Similarity NPC236520
0.8115 Intermediate Similarity NPC294361
0.8103 Intermediate Similarity NPC116842
0.8103 Intermediate Similarity NPC321252
0.8103 Intermediate Similarity NPC252544
0.8092 Intermediate Similarity NPC38158
0.8092 Intermediate Similarity NPC266245
0.8087 Intermediate Similarity NPC31274
0.8087 Intermediate Similarity NPC17525
0.808 Intermediate Similarity NPC123506
0.8065 Intermediate Similarity NPC273683
0.8062 Intermediate Similarity NPC323379
0.8062 Intermediate Similarity NPC327204
0.8056 Intermediate Similarity NPC181709
0.8051 Intermediate Similarity NPC109241
0.8051 Intermediate Similarity NPC242136
0.8049 Intermediate Similarity NPC154696
0.8049 Intermediate Similarity NPC31936
0.8047 Intermediate Similarity NPC198305
0.8045 Intermediate Similarity NPC322021
0.8034 Intermediate Similarity NPC114682
0.8031 Intermediate Similarity NPC217431
0.803 Intermediate Similarity NPC264022
0.8018 Intermediate Similarity NPC130193
0.8018 Intermediate Similarity NPC245561
0.8017 Intermediate Similarity NPC326187
0.8017 Intermediate Similarity NPC249435
0.8017 Intermediate Similarity NPC152159
0.8016 Intermediate Similarity NPC471929
0.8016 Intermediate Similarity NPC471930
0.8016 Intermediate Similarity NPC471935
0.8016 Intermediate Similarity NPC71610
0.8 Intermediate Similarity NPC477281
0.8 Intermediate Similarity NPC477280
0.8 Intermediate Similarity NPC141523
0.8 Intermediate Similarity NPC471928
0.8 Intermediate Similarity NPC471924
0.8 Intermediate Similarity NPC19719
0.8 Intermediate Similarity NPC471925
0.8 Intermediate Similarity NPC128249
0.7984 Intermediate Similarity NPC86900
0.7984 Intermediate Similarity NPC68167
0.7984 Intermediate Similarity NPC282577
0.7983 Intermediate Similarity NPC114144
0.7969 Intermediate Similarity NPC171460
0.7969 Intermediate Similarity NPC304622
0.7967 Intermediate Similarity NPC32322
0.7967 Intermediate Similarity NPC259703
0.7967 Intermediate Similarity NPC98305
0.7967 Intermediate Similarity NPC216216
0.7963 Intermediate Similarity NPC304541
0.7955 Intermediate Similarity NPC475549
0.7953 Intermediate Similarity NPC123228
0.7953 Intermediate Similarity NPC151167
0.7953 Intermediate Similarity NPC276466
0.7953 Intermediate Similarity NPC5018
0.7953 Intermediate Similarity NPC123722
0.7951 Intermediate Similarity NPC473974
0.7951 Intermediate Similarity NPC182240
0.7951 Intermediate Similarity NPC258366
0.7951 Intermediate Similarity NPC473767
0.7951 Intermediate Similarity NPC31296
0.7951 Intermediate Similarity NPC79933
0.7946 Intermediate Similarity NPC52472
0.7937 Intermediate Similarity NPC287473
0.7934 Intermediate Similarity NPC325295
0.7934 Intermediate Similarity NPC471926
0.7934 Intermediate Similarity NPC76308
0.7931 Intermediate Similarity NPC224584
0.7928 Intermediate Similarity NPC201967
0.7923 Intermediate Similarity NPC477407
0.7923 Intermediate Similarity NPC312560
0.7923 Intermediate Similarity NPC309430
0.792 Intermediate Similarity NPC257976
0.792 Intermediate Similarity NPC473942
0.792 Intermediate Similarity NPC242372
0.792 Intermediate Similarity NPC4181
0.792 Intermediate Similarity NPC164778
0.7907 Intermediate Similarity NPC146615
0.7903 Intermediate Similarity NPC295034
0.7899 Intermediate Similarity NPC148969
0.7891 Intermediate Similarity NPC24869
0.7891 Intermediate Similarity NPC96024
0.7886 Intermediate Similarity NPC318552
0.7886 Intermediate Similarity NPC478121
0.7886 Intermediate Similarity NPC190501
0.7881 Intermediate Similarity NPC268388
0.7879 Intermediate Similarity NPC22644
0.7874 Intermediate Similarity NPC179777
0.7874 Intermediate Similarity NPC90128
0.7874 Intermediate Similarity NPC303680
0.7874 Intermediate Similarity NPC231774
0.7874 Intermediate Similarity NPC84076
0.787 Intermediate Similarity NPC476484
0.7869 Intermediate Similarity NPC311091
0.7869 Intermediate Similarity NPC471033
0.7863 Intermediate Similarity NPC171968
0.7863 Intermediate Similarity NPC475627
0.7863 Intermediate Similarity NPC475346
0.7863 Intermediate Similarity NPC475457
0.7863 Intermediate Similarity NPC18982
0.7857 Intermediate Similarity NPC273686
0.7857 Intermediate Similarity NPC199273
0.7857 Intermediate Similarity NPC312404
0.7857 Intermediate Similarity NPC310540
0.7857 Intermediate Similarity NPC231767
0.7851 Intermediate Similarity NPC477453
0.7846 Intermediate Similarity NPC108553
0.784 Intermediate Similarity NPC121168
0.784 Intermediate Similarity NPC114298
0.784 Intermediate Similarity NPC91478
0.7838 Intermediate Similarity NPC473388
0.7838 Intermediate Similarity NPC216520
0.7838 Intermediate Similarity NPC132271
0.7838 Intermediate Similarity NPC292730
0.7838 Intermediate Similarity NPC82664
0.7833 Intermediate Similarity NPC221870
0.7826 Intermediate Similarity NPC127676
0.7823 Intermediate Similarity NPC248363
0.7823 Intermediate Similarity NPC164852
0.7815 Intermediate Similarity NPC228988
0.7812 Intermediate Similarity NPC262936
0.7812 Intermediate Similarity NPC477212
0.7812 Intermediate Similarity NPC319422
0.7812 Intermediate Similarity NPC477214
0.7812 Intermediate Similarity NPC72667
0.7812 Intermediate Similarity NPC30491
0.7812 Intermediate Similarity NPC477211
0.781 Intermediate Similarity NPC478164
0.7807 Intermediate Similarity NPC298224
0.7805 Intermediate Similarity NPC42657
0.7803 Intermediate Similarity NPC194970
0.7797 Intermediate Similarity NPC183700
0.7795 Intermediate Similarity NPC127975
0.7795 Intermediate Similarity NPC257589
0.7795 Intermediate Similarity NPC53305
0.7788 Intermediate Similarity NPC253746
0.7787 Intermediate Similarity NPC150919
0.7787 Intermediate Similarity NPC469954
0.7786 Intermediate Similarity NPC173034

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC325646 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
0.8033 Intermediate Similarity NPD2932 Approved
0.8018 Intermediate Similarity NPD3020 Approved
0.7899 Intermediate Similarity NPD1241 Discontinued
0.7886 Intermediate Similarity NPD3019 Approved
0.7748 Intermediate Similarity NPD2859 Approved
0.7748 Intermediate Similarity NPD2860 Approved
0.7717 Intermediate Similarity NPD1876 Approved
0.7705 Intermediate Similarity NPD405 Clinical (unspecified phase)
0.7661 Intermediate Similarity NPD4196 Clinical (unspecified phase)
0.7658 Intermediate Similarity NPD2933 Approved
0.7658 Intermediate Similarity NPD2934 Approved
0.7658 Intermediate Similarity NPD1432 Clinical (unspecified phase)
0.7594 Intermediate Similarity NPD6355 Discontinued
0.7586 Intermediate Similarity NPD1237 Approved
0.7581 Intermediate Similarity NPD9545 Approved
0.7563 Intermediate Similarity NPD3022 Approved
0.7563 Intermediate Similarity NPD3021 Approved
0.7559 Intermediate Similarity NPD3972 Approved
0.7542 Intermediate Similarity NPD9265 Clinical (unspecified phase)
0.7541 Intermediate Similarity NPD690 Clinical (unspecified phase)
0.7536 Intermediate Similarity NPD8166 Discontinued
0.75 Intermediate Similarity NPD4379 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD3764 Approved
0.7462 Intermediate Similarity NPD2798 Approved
0.7442 Intermediate Similarity NPD1283 Approved
0.7426 Intermediate Similarity NPD3299 Clinical (unspecified phase)
0.7426 Intermediate Similarity NPD2799 Discontinued
0.7419 Intermediate Similarity NPD9493 Approved
0.7411 Intermediate Similarity NPD5122 Clinical (unspecified phase)
0.7402 Intermediate Similarity NPD3026 Approved
0.7402 Intermediate Similarity NPD3023 Approved
0.7388 Intermediate Similarity NPD1240 Approved
0.7385 Intermediate Similarity NPD1164 Approved
0.7385 Intermediate Similarity NPD2797 Approved
0.7385 Intermediate Similarity NPD1470 Approved
0.7381 Intermediate Similarity NPD3024 Approved
0.7381 Intermediate Similarity NPD1651 Approved
0.7381 Intermediate Similarity NPD3025 Approved
0.7372 Intermediate Similarity NPD2935 Discontinued
0.7368 Intermediate Similarity NPD6798 Discontinued
0.7368 Intermediate Similarity NPD288 Approved
0.7368 Intermediate Similarity NPD3268 Approved
0.7344 Intermediate Similarity NPD1201 Approved
0.7339 Intermediate Similarity NPD255 Approved
0.7339 Intermediate Similarity NPD256 Approved
0.7319 Intermediate Similarity NPD2344 Approved
0.7315 Intermediate Similarity NPD111 Approved
0.7313 Intermediate Similarity NPD6663 Approved
0.7299 Intermediate Similarity NPD1510 Phase 2
0.7286 Intermediate Similarity NPD3750 Approved
0.7279 Intermediate Similarity NPD1607 Approved
0.7273 Intermediate Similarity NPD5736 Approved
0.7266 Intermediate Similarity NPD3847 Discontinued
0.7259 Intermediate Similarity NPD4060 Phase 1
0.7257 Intermediate Similarity NPD845 Approved
0.7241 Intermediate Similarity NPD2066 Phase 3
0.7222 Intermediate Similarity NPD5536 Phase 2
0.7209 Intermediate Similarity NPD1535 Discovery
0.7209 Intermediate Similarity NPD1281 Approved
0.7203 Intermediate Similarity NPD1931 Clinical (unspecified phase)
0.7203 Intermediate Similarity NPD1930 Approved
0.7203 Intermediate Similarity NPD1929 Approved
0.7203 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.719 Intermediate Similarity NPD74 Approved
0.719 Intermediate Similarity NPD6831 Clinical (unspecified phase)
0.719 Intermediate Similarity NPD9266 Approved
0.7188 Intermediate Similarity NPD4626 Approved
0.7185 Intermediate Similarity NPD4062 Phase 3
0.7185 Intermediate Similarity NPD6233 Phase 2
0.7179 Intermediate Similarity NPD289 Clinical (unspecified phase)
0.7177 Intermediate Similarity NPD2228 Approved
0.7177 Intermediate Similarity NPD2229 Approved
0.7177 Intermediate Similarity NPD2234 Approved
0.7167 Intermediate Similarity NPD3134 Approved
0.7165 Intermediate Similarity NPD1894 Discontinued
0.7164 Intermediate Similarity NPD7095 Approved
0.7163 Intermediate Similarity NPD7003 Approved
0.7163 Intermediate Similarity NPD4628 Phase 3
0.7154 Intermediate Similarity NPD1481 Phase 2
0.7154 Intermediate Similarity NPD1608 Approved
0.7143 Intermediate Similarity NPD9494 Approved
0.7143 Intermediate Similarity NPD5909 Discontinued
0.7132 Intermediate Similarity NPD943 Approved
0.7131 Intermediate Similarity NPD4750 Phase 3
0.713 Intermediate Similarity NPD1809 Phase 2
0.713 Intermediate Similarity NPD844 Approved
0.7121 Intermediate Similarity NPD3267 Approved
0.7121 Intermediate Similarity NPD3266 Approved
0.712 Intermediate Similarity NPD2629 Approved
0.7119 Intermediate Similarity NPD846 Approved
0.7119 Intermediate Similarity NPD940 Approved
0.7113 Intermediate Similarity NPD2309 Approved
0.7113 Intermediate Similarity NPD2354 Approved
0.7107 Intermediate Similarity NPD9264 Approved
0.7107 Intermediate Similarity NPD9263 Approved
0.7107 Intermediate Similarity NPD9267 Approved
0.7099 Intermediate Similarity NPD3600 Clinical (unspecified phase)
0.7099 Intermediate Similarity NPD1755 Approved
0.7092 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7059 Intermediate Similarity NPD6647 Phase 2
0.705 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.705 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7042 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.704 Intermediate Similarity NPD5283 Phase 1
0.7031 Intermediate Similarity NPD3091 Approved
0.7023 Intermediate Similarity NPD9717 Approved
0.7021 Intermediate Similarity NPD5958 Discontinued
0.7021 Intermediate Similarity NPD4534 Discontinued
0.7021 Intermediate Similarity NPD1549 Phase 2
0.7021 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7016 Intermediate Similarity NPD228 Approved
0.7016 Intermediate Similarity NPD1609 Clinical (unspecified phase)
0.7009 Intermediate Similarity NPD9495 Approved
0.7008 Intermediate Similarity NPD9568 Approved
0.7007 Intermediate Similarity NPD7458 Discontinued
0.6993 Remote Similarity NPD6190 Approved
0.6992 Remote Similarity NPD987 Approved
0.6992 Remote Similarity NPD1203 Approved
0.6992 Remote Similarity NPD2067 Discontinued
0.6985 Remote Similarity NPD2313 Discontinued
0.6967 Remote Similarity NPD1358 Approved
0.6963 Remote Similarity NPD2614 Approved
0.695 Remote Similarity NPD2355 Clinical (unspecified phase)
0.695 Remote Similarity NPD1552 Clinical (unspecified phase)
0.695 Remote Similarity NPD1550 Clinical (unspecified phase)
0.695 Remote Similarity NPD2353 Approved
0.695 Remote Similarity NPD2343 Clinical (unspecified phase)
0.6947 Remote Similarity NPD1547 Clinical (unspecified phase)
0.6944 Remote Similarity NPD3300 Phase 2
0.694 Remote Similarity NPD257 Approved
0.694 Remote Similarity NPD258 Approved
0.6935 Remote Similarity NPD4141 Clinical (unspecified phase)
0.6929 Remote Similarity NPD4308 Phase 3
0.6929 Remote Similarity NPD7157 Approved
0.6929 Remote Similarity NPD3748 Approved
0.6923 Remote Similarity NPD1878 Clinical (unspecified phase)
0.6923 Remote Similarity NPD17 Approved
0.6923 Remote Similarity NPD2668 Approved
0.6923 Remote Similarity NPD2667 Approved
0.6911 Remote Similarity NPD2684 Approved
0.6908 Remote Similarity NPD7075 Discontinued
0.6897 Remote Similarity NPD6799 Approved
0.6891 Remote Similarity NPD3028 Approved
0.6891 Remote Similarity NPD1242 Phase 1
0.6889 Remote Similarity NPD4208 Discontinued
0.6885 Remote Similarity NPD1445 Approved
0.6885 Remote Similarity NPD1444 Approved
0.6884 Remote Similarity NPD2979 Phase 3
0.6884 Remote Similarity NPD825 Approved
0.6884 Remote Similarity NPD826 Approved
0.688 Remote Similarity NPD6124 Clinical (unspecified phase)
0.6879 Remote Similarity NPD5406 Approved
0.6879 Remote Similarity NPD5404 Approved
0.6879 Remote Similarity NPD5408 Approved
0.6879 Remote Similarity NPD5405 Approved
0.6875 Remote Similarity NPD3887 Approved
0.6861 Remote Similarity NPD6859 Clinical (unspecified phase)
0.6855 Remote Similarity NPD1792 Phase 2
0.685 Remote Similarity NPD9281 Approved
0.685 Remote Similarity NPD5951 Approved
0.6846 Remote Similarity NPD7028 Phase 2
0.6846 Remote Similarity NPD5691 Approved
0.6846 Remote Similarity NPD6599 Discontinued
0.6842 Remote Similarity NPD9256 Approved
0.6842 Remote Similarity NPD9258 Approved
0.6842 Remote Similarity NPD3882 Suspended
0.6838 Remote Similarity NPD4908 Phase 1
0.6835 Remote Similarity NPD230 Phase 1
0.6831 Remote Similarity NPD2346 Discontinued
0.6831 Remote Similarity NPD1471 Phase 3
0.6825 Remote Similarity NPD7843 Approved
0.6825 Remote Similarity NPD5535 Approved
0.6825 Remote Similarity NPD7635 Approved
0.6821 Remote Similarity NPD7096 Clinical (unspecified phase)
0.6818 Remote Similarity NPD3092 Approved
0.6818 Remote Similarity NPD1610 Phase 2
0.6818 Remote Similarity NPD422 Phase 1
0.6815 Remote Similarity NPD6007 Clinical (unspecified phase)
0.6815 Remote Similarity NPD5647 Approved
0.6812 Remote Similarity NPD259 Phase 1
0.6812 Remote Similarity NPD8032 Phase 2
0.6806 Remote Similarity NPD4109 Clinical (unspecified phase)
0.6806 Remote Similarity NPD4110 Phase 3
0.6803 Remote Similarity NPD5049 Phase 3
0.6803 Remote Similarity NPD6273 Approved
0.6797 Remote Similarity NPD6671 Approved
0.6797 Remote Similarity NPD4198 Discontinued
0.6794 Remote Similarity NPD3095 Discontinued
0.6794 Remote Similarity NPD5306 Approved
0.6794 Remote Similarity NPD4059 Approved
0.6794 Remote Similarity NPD3412 Clinical (unspecified phase)
0.6794 Remote Similarity NPD5305 Approved
0.6786 Remote Similarity NPD6651 Approved
0.6781 Remote Similarity NPD6143 Clinical (unspecified phase)
0.6777 Remote Similarity NPD9261 Approved
0.6776 Remote Similarity NPD8443 Clinical (unspecified phase)
0.6772 Remote Similarity NPD7159 Clinical (unspecified phase)
0.6769 Remote Similarity NPD1759 Phase 1
0.6767 Remote Similarity NPD4878 Approved
0.6767 Remote Similarity NPD9269 Phase 2

Structure

External Identifiers

PubChem CID   3950721
ChEMBL   CHEMBL1374504
ZINC  

Physicochemical Properties

Molecular Weight:  270.09
ALogP:  -0.2539
MLogP:  2.78
XLogP:  2.363
# Rotatable Bonds:  6
Polar Surface Area:  63.6
# H-Bond Aceptor:  3
# H-Bond Donor:  1
# Rings:  2
# Heavy Atoms:  20

Download Data

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