Natural Product: NPC47152

Natural Product ID:  NPC47152
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C20H12O4
Standard InCHIKey:  LVOXAJYEGVDSQA-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C20H12O4/c21-14-7-3-6-13-19(14)15(22)10-11-20(13)23-16-8-1-4-12-5-2-9-17(24-20)18(12)16/h1-11,21H
Canonical SMILES:  O=C1C=CC2(c3c1c(O)ccc3)Oc1cccc3c1c(O2)ccc3
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
NPO23674 Jatropha curcas Species Euphorbiaceae Eukaryota TCMID*
NPO20542 Vellozia phalocarpa Species Velloziaceae Eukaryota UNPD*
NPO27979 Guatteria friesiana Species Annonaceae Eukaryota UNPD*
NPO19400 Cussonia natalensis Species Araliaceae Eukaryota UNPD*
NPO8904 Oreocnide frutescens Species Urticaceae Eukaryota UNPD*
NPO20809 Sarcophyton trocheliophorum Species Alcyoniidae Eukaryota UNPD*
NPO21877 Aplysilla violacea Species Darwinellidae Eukaryota UNPD*
NPO22387 Guettarda speciosa Species Rubiaceae Eukaryota UNPD*
NPO21115 Crepidiastrum keiskeanum Species Asteraceae Eukaryota UNPD*
NPO28371 Echinodontium japonicum Species Echinodontiaceae Eukaryota UNPD*
NPO17178 Labisia pumila Species Primulaceae Eukaryota UNPD*
NPO22001 Delphinus longirostris Species Delphinidae Eukaryota UNPD*
NPO18233 Capparis sepiaria Species Capparaceae Eukaryota UNPD*
NPO2283 Epichloe uncinata Species Clavicipitaceae Eukaryota UNPD*
NPO22325 Caesalpinia sepiaria Species Fabaceae Eukaryota UNPD*
NPO26602 Ranunculus cantoniensis Species Ranunculaceae Eukaryota UNPD*
NPO22513 Decaisnella thyridioides Species Massarinaceae Eukaryota UNPD*
NPO20220 Coccus citri Species Coccidae Eukaryota UNPD*
NPO10812 Beaucarnea hookeri Species Asparagaceae Eukaryota UNPD*
NPO23179 Penicillium paraherquei Species Aspergillaceae Eukaryota UNPD*
NPO22585 Thymus striatus Species Lamiaceae Eukaryota UNPD*
NPO21512 Salvia cardiophylla Species Lamiaceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT3005 Protein Family Thioredoxin reductase Homo sapiens IC50 = 12000 nM 11551767
NPT3005 Protein Family Thioredoxin reductase Homo sapiens IC50 = 350 nM 11551767
NPT82 Cell Line MDA-MB-231 Homo sapiens IC50 = 2400 nM 11551767
NPT83 Cell Line MCF7 Homo sapiens IC50 = 1000 nM 11551767
NPT2 Others Unspecified IC50 = 1600 nM 26539727

  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 NPC47152 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
0.9784 High Similarity NPC306816
0.9645 High Similarity NPC301949
0.9574 High Similarity NPC473951
0.9091 High Similarity NPC133585
0.9034 High Similarity NPC97662
0.9 High Similarity NPC57141
0.8958 High Similarity NPC197461
0.8897 High Similarity NPC257404
0.8831 High Similarity NPC472157
0.8831 High Similarity NPC73148
0.8819 High Similarity NPC473499
0.8716 High Similarity NPC206579
0.8716 High Similarity NPC11800
0.8582 High Similarity NPC141549
0.8511 High Similarity NPC7569
0.8511 High Similarity NPC278787
0.8493 Intermediate Similarity NPC18457
0.8462 Intermediate Similarity NPC193749
0.8457 Intermediate Similarity NPC85368
0.8431 Intermediate Similarity NPC39819
0.8421 Intermediate Similarity NPC70764
0.8378 Intermediate Similarity NPC145673
0.8366 Intermediate Similarity NPC470107
0.8366 Intermediate Similarity NPC295036
0.8355 Intermediate Similarity NPC106328
0.8355 Intermediate Similarity NPC35150
0.8345 Intermediate Similarity NPC193805
0.8344 Intermediate Similarity NPC24748
0.8344 Intermediate Similarity NPC211565
0.8344 Intermediate Similarity NPC183402
0.8344 Intermediate Similarity NPC59491
0.8333 Intermediate Similarity NPC472160
0.8333 Intermediate Similarity NPC472159
0.8322 Intermediate Similarity NPC69755
0.8313 Intermediate Similarity NPC297404
0.8313 Intermediate Similarity NPC11608
0.8312 Intermediate Similarity NPC115324
0.8312 Intermediate Similarity NPC193976
0.8312 Intermediate Similarity NPC23668
0.8302 Intermediate Similarity NPC101116
0.8302 Intermediate Similarity NPC212099
0.8302 Intermediate Similarity NPC278329
0.8302 Intermediate Similarity NPC146837
0.8291 Intermediate Similarity NPC292863
0.8291 Intermediate Similarity NPC184326
0.8289 Intermediate Similarity NPC71055
0.828 Intermediate Similarity NPC67197
0.8278 Intermediate Similarity NPC131766
0.8272 Intermediate Similarity NPC222455
0.8269 Intermediate Similarity NPC99199
0.8269 Intermediate Similarity NPC254351
0.8267 Intermediate Similarity NPC310340
0.8267 Intermediate Similarity NPC169479
0.8267 Intermediate Similarity NPC159855
0.8258 Intermediate Similarity NPC281272
0.8258 Intermediate Similarity NPC207624
0.8258 Intermediate Similarity NPC142308
0.8255 Intermediate Similarity NPC275734
0.8253 Intermediate Similarity NPC277710
0.8253 Intermediate Similarity NPC153578
0.8253 Intermediate Similarity NPC114257
0.8253 Intermediate Similarity NPC299149
0.825 Intermediate Similarity NPC159508
0.8247 Intermediate Similarity NPC227122
0.8247 Intermediate Similarity NPC325983
0.8242 Intermediate Similarity NPC101991
0.8239 Intermediate Similarity NPC18380
0.8239 Intermediate Similarity NPC137232
0.8232 Intermediate Similarity NPC203751
0.8231 Intermediate Similarity NPC477534
0.8228 Intermediate Similarity NPC195167
0.8224 Intermediate Similarity NPC60389
0.8217 Intermediate Similarity NPC137100
0.8217 Intermediate Similarity NPC13879
0.8217 Intermediate Similarity NPC469507
0.8217 Intermediate Similarity NPC279605
0.821 Intermediate Similarity NPC103633
0.821 Intermediate Similarity NPC63470
0.8207 Intermediate Similarity NPC138940
0.8205 Intermediate Similarity NPC95842
0.8205 Intermediate Similarity NPC299761
0.8205 Intermediate Similarity NPC280530
0.8205 Intermediate Similarity NPC279281
0.8205 Intermediate Similarity NPC230439
0.8205 Intermediate Similarity NPC178964
0.8205 Intermediate Similarity NPC235333
0.8205 Intermediate Similarity NPC185103
0.8205 Intermediate Similarity NPC92153
0.8199 Intermediate Similarity NPC178281
0.8194 Intermediate Similarity NPC137264
0.8194 Intermediate Similarity NPC149085
0.8194 Intermediate Similarity NPC106372
0.8194 Intermediate Similarity NPC58668
0.8187 Intermediate Similarity NPC216752
0.8187 Intermediate Similarity NPC469472
0.8182 Intermediate Similarity NPC3718
0.8182 Intermediate Similarity NPC10027
0.8182 Intermediate Similarity NPC472158
0.8182 Intermediate Similarity NPC65775
0.817 Intermediate Similarity NPC12305
0.817 Intermediate Similarity NPC150215
0.8165 Intermediate Similarity NPC177742
0.8165 Intermediate Similarity NPC268360
0.8163 Intermediate Similarity NPC141934
0.816 Intermediate Similarity NPC137460
0.8158 Intermediate Similarity NPC32470
0.8158 Intermediate Similarity NPC98926
0.8158 Intermediate Similarity NPC155144
0.8158 Intermediate Similarity NPC469764
0.8158 Intermediate Similarity NPC469408
0.8158 Intermediate Similarity NPC184649
0.8158 Intermediate Similarity NPC303185
0.8153 Intermediate Similarity NPC55662
0.8153 Intermediate Similarity NPC3898
0.8153 Intermediate Similarity NPC148938
0.8153 Intermediate Similarity NPC166054
0.8153 Intermediate Similarity NPC297531
0.8153 Intermediate Similarity NPC213936
0.8148 Intermediate Similarity NPC472150
0.8148 Intermediate Similarity NPC175082
0.8144 Intermediate Similarity NPC121888
0.8141 Intermediate Similarity NPC473967
0.8141 Intermediate Similarity NPC474843
0.8137 Intermediate Similarity NPC290160
0.8133 Intermediate Similarity NPC475246
0.8133 Intermediate Similarity NPC289876
0.8133 Intermediate Similarity NPC124365
0.8133 Intermediate Similarity NPC102053
0.8129 Intermediate Similarity NPC101957
0.8129 Intermediate Similarity NPC120105
0.8125 Intermediate Similarity NPC472261
0.8125 Intermediate Similarity NPC115998
0.8125 Intermediate Similarity NPC175513
0.8125 Intermediate Similarity NPC39753
0.8121 Intermediate Similarity NPC1268
0.8117 Intermediate Similarity NPC37135
0.8117 Intermediate Similarity NPC186397
0.8113 Intermediate Similarity NPC472156
0.8113 Intermediate Similarity NPC55443
0.8113 Intermediate Similarity NPC18699
0.8113 Intermediate Similarity NPC177650
0.8107 Intermediate Similarity NPC231254
0.8105 Intermediate Similarity NPC299011
0.8105 Intermediate Similarity NPC267509
0.8105 Intermediate Similarity NPC469758
0.8105 Intermediate Similarity NPC300540
0.8101 Intermediate Similarity NPC309648
0.8095 Intermediate Similarity NPC22222
0.8095 Intermediate Similarity NPC281513
0.8092 Intermediate Similarity NPC113770
0.8092 Intermediate Similarity NPC59551
0.8089 Intermediate Similarity NPC477691
0.8089 Intermediate Similarity NPC135522
0.8089 Intermediate Similarity NPC329844
0.8089 Intermediate Similarity NPC214632
0.8086 Intermediate Similarity NPC474591
0.8086 Intermediate Similarity NPC280923
0.8086 Intermediate Similarity NPC169471
0.8082 Intermediate Similarity NPC128216
0.8082 Intermediate Similarity NPC477536
0.8082 Intermediate Similarity NPC287533
0.8079 Intermediate Similarity NPC49108
0.8079 Intermediate Similarity NPC105648
0.8077 Intermediate Similarity NPC67322
0.8077 Intermediate Similarity NPC305965
0.8077 Intermediate Similarity NPC138299
0.8077 Intermediate Similarity NPC222713
0.8077 Intermediate Similarity NPC258249
0.8077 Intermediate Similarity NPC111112
0.8075 Intermediate Similarity NPC477528
0.8075 Intermediate Similarity NPC3448
0.8075 Intermediate Similarity NPC477239
0.8072 Intermediate Similarity NPC470667
0.8069 Intermediate Similarity NPC284232
0.8067 Intermediate Similarity NPC477537
0.8065 Intermediate Similarity NPC266499
0.8065 Intermediate Similarity NPC473978
0.8065 Intermediate Similarity NPC223988
0.8065 Intermediate Similarity NPC472837
0.8063 Intermediate Similarity NPC328093
0.8063 Intermediate Similarity NPC312993
0.8063 Intermediate Similarity NPC186325
0.8061 Intermediate Similarity NPC30432
0.8061 Intermediate Similarity NPC478002
0.8061 Intermediate Similarity NPC76128
0.8061 Intermediate Similarity NPC271385
0.8061 Intermediate Similarity NPC111536
0.8061 Intermediate Similarity NPC5029
0.8059 Intermediate Similarity NPC87583
0.8056 Intermediate Similarity NPC197425
0.8054 Intermediate Similarity NPC290291
0.8054 Intermediate Similarity NPC472151
0.8054 Intermediate Similarity NPC275055
0.8052 Intermediate Similarity NPC77903
0.8052 Intermediate Similarity NPC259632
0.8052 Intermediate Similarity NPC17101
0.8052 Intermediate Similarity NPC46941
0.8052 Intermediate Similarity NPC17816
0.805 Intermediate Similarity NPC201127
0.805 Intermediate Similarity NPC164110

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC47152 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
0.8425 Intermediate Similarity NPD2346 Discontinued
0.828 Intermediate Similarity NPD3749 Approved
0.8255 Intermediate Similarity NPD3750 Approved
0.8156 Intermediate Similarity NPD1203 Approved
0.8125 Intermediate Similarity NPD2313 Discontinued
0.8098 Intermediate Similarity NPD3751 Discontinued
0.8065 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.8065 Intermediate Similarity NPD3226 Approved
0.8024 Intermediate Similarity NPD8313 Approved
0.8024 Intermediate Similarity NPD8312 Approved
0.8012 Intermediate Similarity NPD6959 Discontinued
0.7972 Intermediate Similarity NPD2798 Approved
0.7937 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.7933 Intermediate Similarity NPD2344 Approved
0.7919 Intermediate Similarity NPD3748 Approved
0.7881 Intermediate Similarity NPD1549 Phase 2
0.7867 Intermediate Similarity NPD2935 Discontinued
0.7862 Intermediate Similarity NPD7819 Suspended
0.7857 Intermediate Similarity NPD1511 Approved
0.7838 Intermediate Similarity NPD1933 Approved
0.7838 Intermediate Similarity NPD447 Suspended
0.7817 Intermediate Similarity NPD9717 Approved
0.7815 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.7815 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.7806 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.78 Intermediate Similarity NPD2799 Discontinued
0.7778 Intermediate Similarity NPD1470 Approved
0.7778 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.7764 Intermediate Similarity NPD7768 Phase 2
0.7758 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7756 Intermediate Similarity NPD1512 Approved
0.7748 Intermediate Similarity NPD1551 Phase 2
0.7746 Intermediate Similarity NPD1547 Clinical (unspecified phase)
0.7744 Intermediate Similarity NPD3787 Discontinued
0.7736 Intermediate Similarity NPD7411 Suspended
0.7727 Intermediate Similarity NPD2309 Approved
0.7725 Intermediate Similarity NPD7054 Approved
0.7718 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7702 Intermediate Similarity NPD5402 Approved
0.7702 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7698 Intermediate Similarity NPD405 Clinical (unspecified phase)
0.7692 Intermediate Similarity NPD6559 Discontinued
0.7692 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.7688 Intermediate Similarity NPD1934 Approved
0.7682 Intermediate Similarity NPD1510 Phase 2
0.7679 Intermediate Similarity NPD7074 Phase 3
0.7679 Intermediate Similarity NPD7472 Approved
0.7665 Intermediate Similarity NPD3818 Discontinued
0.7654 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7651 Intermediate Similarity NPD6166 Phase 2
0.7651 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.7651 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.7647 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.764 Intermediate Similarity NPD2801 Approved
0.764 Intermediate Similarity NPD1465 Phase 2
0.764 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.7636 Intermediate Similarity NPD6232 Discontinued
0.7635 Intermediate Similarity NPD411 Approved
0.7633 Intermediate Similarity NPD6797 Phase 2
0.7632 Intermediate Similarity NPD5405 Approved
0.7632 Intermediate Similarity NPD5406 Approved
0.7632 Intermediate Similarity NPD5404 Approved
0.7632 Intermediate Similarity NPD5408 Approved
0.7622 Intermediate Similarity NPD1201 Approved
0.7619 Intermediate Similarity NPD6832 Phase 2
0.7605 Intermediate Similarity NPD7473 Discontinued
0.7588 Intermediate Similarity NPD7251 Discontinued
0.7586 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.7566 Intermediate Similarity NPD4308 Phase 3
0.7562 Intermediate Similarity NPD4380 Phase 2
0.7548 Intermediate Similarity NPD7003 Approved
0.7544 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7544 Intermediate Similarity NPD7808 Phase 3
0.7534 Intermediate Similarity NPD2797 Approved
0.7533 Intermediate Similarity NPD1240 Approved
0.7517 Intermediate Similarity NPD3268 Approved
0.7517 Intermediate Similarity NPD3764 Approved
0.7516 Intermediate Similarity NPD7390 Discontinued
0.7515 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.7515 Intermediate Similarity NPD5844 Phase 1
0.75 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7484 Intermediate Similarity NPD5403 Approved
0.7469 Intermediate Similarity NPD6844 Discontinued
0.7468 Intermediate Similarity NPD5401 Approved
0.7468 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7468 Intermediate Similarity NPD2343 Clinical (unspecified phase)
0.7451 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.7439 Intermediate Similarity NPD3882 Suspended
0.7436 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7434 Intermediate Similarity NPD1607 Approved
0.7403 Intermediate Similarity NPD2796 Approved
0.7394 Intermediate Similarity NPD7075 Discontinued
0.7372 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7372 Intermediate Similarity NPD2800 Approved
0.7347 Intermediate Similarity NPD3225 Approved
0.7326 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7324 Intermediate Similarity NPD9493 Approved
0.7317 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7305 Intermediate Similarity NPD5494 Approved
0.7303 Intermediate Similarity NPD4307 Phase 2
0.7297 Intermediate Similarity NPD3267 Approved
0.7297 Intermediate Similarity NPD3266 Approved
0.7296 Intermediate Similarity NPD6799 Approved
0.729 Intermediate Similarity NPD6100 Approved
0.729 Intermediate Similarity NPD6099 Approved
0.7288 Intermediate Similarity NPD4287 Approved
0.7284 Intermediate Similarity NPD7458 Discontinued
0.7273 Intermediate Similarity NPD3817 Phase 2
0.7273 Intermediate Similarity NPD4288 Approved
0.725 Intermediate Similarity NPD2534 Approved
0.725 Intermediate Similarity NPD2532 Approved
0.725 Intermediate Similarity NPD2533 Approved
0.7248 Intermediate Similarity NPD1019 Discontinued
0.7244 Intermediate Similarity NPD1471 Phase 3
0.7219 Intermediate Similarity NPD4625 Phase 3
0.7213 Intermediate Similarity NPD6777 Approved
0.7213 Intermediate Similarity NPD6780 Approved
0.7213 Intermediate Similarity NPD6781 Approved
0.7213 Intermediate Similarity NPD6778 Approved
0.7213 Intermediate Similarity NPD6779 Approved
0.7213 Intermediate Similarity NPD6776 Approved
0.7213 Intermediate Similarity NPD6782 Approved
0.7212 Intermediate Similarity NPD8455 Phase 2
0.7205 Intermediate Similarity NPD6273 Approved
0.719 Intermediate Similarity NPD943 Approved
0.7181 Intermediate Similarity NPD1164 Approved
0.7169 Intermediate Similarity NPD2296 Approved
0.7152 Intermediate Similarity NPD4908 Phase 1
0.7151 Intermediate Similarity NPD7870 Phase 2
0.7151 Intermediate Similarity NPD7871 Phase 2
0.7135 Intermediate Similarity NPD6823 Phase 2
0.7134 Intermediate Similarity NPD6599 Discontinued
0.7115 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7105 Intermediate Similarity NPD7783 Phase 2
0.7105 Intermediate Similarity NPD7782 Clinical (unspecified phase)
0.7097 Intermediate Similarity NPD7435 Discontinued
0.7097 Intermediate Similarity NPD7698 Approved
0.7097 Intermediate Similarity NPD7697 Approved
0.7097 Intermediate Similarity NPD7696 Phase 3
0.7095 Intermediate Similarity NPD1608 Approved
0.7095 Intermediate Similarity NPD1481 Phase 2
0.709 Intermediate Similarity NPD8151 Discontinued
0.7079 Intermediate Similarity NPD8150 Discontinued
0.7059 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7055 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7055 Intermediate Similarity NPD920 Approved
0.7052 Intermediate Similarity NPD7177 Discontinued
0.7048 Intermediate Similarity NPD6801 Discontinued
0.7044 Intermediate Similarity NPD1243 Approved
0.7037 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7027 Intermediate Similarity NPD1535 Discovery
0.7019 Intermediate Similarity NPD7440 Discontinued
0.7 Intermediate Similarity NPD74 Approved
0.7 Intermediate Similarity NPD1283 Approved
0.7 Intermediate Similarity NPD1876 Approved
0.7 Intermediate Similarity NPD9266 Approved
0.6994 Remote Similarity NPD3446 Phase 1
0.6993 Remote Similarity NPD1241 Discontinued
0.6978 Remote Similarity NPD6213 Phase 3
0.6978 Remote Similarity NPD6214 Clinical (unspecified phase)
0.6978 Remote Similarity NPD6212 Phase 3
0.6977 Remote Similarity NPD3926 Phase 2
0.6975 Remote Similarity NPD6143 Clinical (unspecified phase)
0.6959 Remote Similarity NPD7199 Phase 2
0.6954 Remote Similarity NPD7228 Approved
0.6948 Remote Similarity NPD6859 Clinical (unspecified phase)
0.6948 Remote Similarity NPD6798 Discontinued
0.6947 Remote Similarity NPD7701 Phase 2
0.6946 Remote Similarity NPD37 Approved
0.6941 Remote Similarity NPD6234 Discontinued
0.694 Remote Similarity NPD6534 Approved
0.694 Remote Similarity NPD6535 Approved
0.6933 Remote Similarity NPD4749 Approved
0.6933 Remote Similarity NPD7422 Clinical (unspecified phase)
0.6929 Remote Similarity NPD9263 Approved
0.6929 Remote Similarity NPD9264 Approved
0.6929 Remote Similarity NPD9267 Approved
0.6928 Remote Similarity NPD6585 Discontinued
0.6928 Remote Similarity NPD1529 Clinical (unspecified phase)
0.6923 Remote Similarity NPD4966 Approved
0.6923 Remote Similarity NPD4965 Approved
0.6923 Remote Similarity NPD4967 Phase 2
0.6919 Remote Similarity NPD7229 Phase 3
0.6914 Remote Similarity NPD3300 Phase 2
0.6914 Remote Similarity NPD643 Clinical (unspecified phase)
0.6913 Remote Similarity NPD1611 Approved
0.6913 Remote Similarity NPD1610 Phase 2
0.6903 Remote Similarity NPD6233 Phase 2
0.6899 Remote Similarity NPD3299 Clinical (unspecified phase)
0.6897 Remote Similarity NPD6671 Approved
0.6897 Remote Similarity NPD709 Approved
0.6894 Remote Similarity NPD4628 Phase 3
0.6892 Remote Similarity NPD17 Approved
0.6886 Remote Similarity NPD5889 Approved
0.6886 Remote Similarity NPD5890 Approved
0.6879 Remote Similarity NPD7184 Clinical (unspecified phase)
0.6875 Remote Similarity NPD5441 Clinical (unspecified phase)
0.6875 Remote Similarity NPD7875 Clinical (unspecified phase)
0.6875 Remote Similarity NPD7874 Approved
0.6867 Remote Similarity NPD2651 Approved

Structure

External Identifiers

PubChem CID   196959
ChEMBL   CHEMBL88230
ZINC  

Physicochemical Properties

Molecular Weight:  316.07
ALogP:  -0.6512
MLogP:  3.22
XLogP:  3.957
# Rotatable Bonds:  1
Polar Surface Area:  55.76
# H-Bond Aceptor:  1
# H-Bond Donor:  1
# Rings:  5
# Heavy Atoms:  24

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Biological Activities  
Similar NPs/Drugs