Natural Product: NPC151530

Natural Product ID:  NPC151530
Common Name:   (Z)-Methyl 3-(4-(3,7-Dimethylocta-2,6-Dienyloxy)Phenyl)Acrylate
IUPAC Name:   methyl (Z)-3-[4-[(2E)-3,7-dimethylocta-2,6-dienoxy]phenyl]prop-2-enoate
Synonyms:  
Molecular Formula:   C20H26O3
Standard InCHIKey:  KSSYIBXTLHIBBX-ICMDQPEBSA-N
Standard InCHI:  InChI=1S/C20H26O3/c1-16(2)6-5-7-17(3)14-15-23-19-11-8-18(9-12-19)10-13-20(21)22-4/h6,8-14H,5,7,15H2,1-4H3/b13-10-,17-14+
Canonical SMILES:  COC(=O)/C=Cc1ccc(cc1)OC/C=C(/CCC=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
NPO25148.1 Helichrysum italicum Under-species NA NA Flowered aerial parts Arzana, Sardinia 2010-JUL PMID[23265253]
NPO27879 Ailanthus triphysa Species Simaroubaceae Eukaryota UNPD*
NPO20978 Alternaria cinerariae Species Pleosporaceae Eukaryota UNPD*
NPO8266 Solanum anguivi Species Solanaceae Eukaryota UNPD*
NPO1650 Boykinia watanabei Species Saxifragaceae Eukaryota UNPD*
NPO27381 Hypselodoris webbi Species Chromodorididae Eukaryota UNPD*
NPO27588 Carpolobia lutea Species Polygalaceae Eukaryota UNPD*
NPO29214 Teucrium massiliense Species Lamiaceae Eukaryota UNPD*
NPO23311 Libanothamnus tamanus Species Asteraceae Eukaryota UNPD*
NPO28117 Tor sinensis Species Cyprinidae Eukaryota UNPD*
NPO28152 Jacaranda caucana Species Bignoniaceae Eukaryota UNPD*
NPO26838 Adenophora triphylla Species Campanulaceae Eukaryota UNPD*
NPO27219 Gonioma kamassi Species Apocynaceae Eukaryota UNPD*
NPO28095 Boronia megastigma Species Rutaceae Eukaryota UNPD*
NPO27948 Licania carii Species Chrysobalanaceae Eukaryota UNPD*
NPO27985 Plantago arenaria Species Plantaginaceae Eukaryota UNPD*
NPO11450 Pseudoceratina purpurea Species Pseudoceratinidae Eukaryota UNPD*
NPO15808 Vibrio gazogenes Species Vibrionaceae Bacteria UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC > 128 ug/ml 23265253

  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 NPC151530 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 NPC157473
0.9899 High Similarity NPC176971
0.9798 High Similarity NPC128730
0.97 High Similarity NPC326447
0.9596 High Similarity NPC179686
0.9406 High Similarity NPC473855
0.9307 High Similarity NPC283546
0.9216 High Similarity NPC473393
0.92 High Similarity NPC107101
0.9118 High Similarity NPC109637
0.9118 High Similarity NPC2518
0.9109 High Similarity NPC307425
0.901 High Similarity NPC13755
0.9 High Similarity NPC175298
0.8962 High Similarity NPC473809
0.8952 High Similarity NPC291837
0.8911 High Similarity NPC471576
0.8846 High Similarity NPC238115
0.8835 High Similarity NPC192596
0.8829 High Similarity NPC293424
0.8785 High Similarity NPC231251
0.8785 High Similarity NPC25067
0.8785 High Similarity NPC88868
0.8761 High Similarity NPC235190
0.8761 High Similarity NPC180006
0.875 High Similarity NPC37858
0.8738 High Similarity NPC51633
0.8692 High Similarity NPC149545
0.8667 High Similarity NPC470393
0.8667 High Similarity NPC288760
0.8667 High Similarity NPC139891
0.8667 High Similarity NPC227255
0.8661 High Similarity NPC277460
0.8654 High Similarity NPC304638
0.8624 High Similarity NPC199462
0.8596 High Similarity NPC163200
0.8584 High Similarity NPC281356
0.8584 High Similarity NPC98748
0.8571 High Similarity NPC108875
0.8571 High Similarity NPC263754
0.8571 High Similarity NPC38079
0.8571 High Similarity NPC183154
0.8558 High Similarity NPC84325
0.8545 High Similarity NPC90903
0.8532 High Similarity NPC245552
0.8519 High Similarity NPC259554
0.8515 High Similarity NPC471581
0.8505 High Similarity NPC260952
0.8496 Intermediate Similarity NPC124916
0.8496 Intermediate Similarity NPC265547
0.8496 Intermediate Similarity NPC159916
0.8485 Intermediate Similarity NPC8002
0.8485 Intermediate Similarity NPC99886
0.8485 Intermediate Similarity NPC259134
0.8485 Intermediate Similarity NPC177844
0.8482 Intermediate Similarity NPC470860
0.8468 Intermediate Similarity NPC235250
0.8468 Intermediate Similarity NPC252004
0.8468 Intermediate Similarity NPC87563
0.8462 Intermediate Similarity NPC253746
0.8462 Intermediate Similarity NPC221798
0.8435 Intermediate Similarity NPC322569
0.8426 Intermediate Similarity NPC206341
0.8421 Intermediate Similarity NPC298796
0.8421 Intermediate Similarity NPC264976
0.8411 Intermediate Similarity NPC1065
0.84 Intermediate Similarity NPC71853
0.8393 Intermediate Similarity NPC296526
0.8378 Intermediate Similarity NPC303522
0.8376 Intermediate Similarity NPC273772
0.8376 Intermediate Similarity NPC109675
0.8376 Intermediate Similarity NPC21238
0.8365 Intermediate Similarity NPC171843
0.8364 Intermediate Similarity NPC139946
0.8362 Intermediate Similarity NPC114845
0.8348 Intermediate Similarity NPC31314
0.8348 Intermediate Similarity NPC193193
0.8333 Intermediate Similarity NPC96705
0.8333 Intermediate Similarity NPC258171
0.8333 Intermediate Similarity NPC152306
0.8319 Intermediate Similarity NPC33717
0.8319 Intermediate Similarity NPC128633
0.8319 Intermediate Similarity NPC127604
0.8318 Intermediate Similarity NPC127676
0.8317 Intermediate Similarity NPC321956
0.8305 Intermediate Similarity NPC73413
0.8305 Intermediate Similarity NPC27671
0.8305 Intermediate Similarity NPC201667
0.8304 Intermediate Similarity NPC294941
0.8291 Intermediate Similarity NPC96286
0.8291 Intermediate Similarity NPC69403
0.8291 Intermediate Similarity NPC248429
0.8291 Intermediate Similarity NPC288238
0.8291 Intermediate Similarity NPC291189
0.8276 Intermediate Similarity NPC204466
0.8273 Intermediate Similarity NPC179309
0.8273 Intermediate Similarity NPC183700
0.8261 Intermediate Similarity NPC69670
0.825 Intermediate Similarity NPC224774
0.825 Intermediate Similarity NPC121740
0.825 Intermediate Similarity NPC258567
0.823 Intermediate Similarity NPC220540
0.823 Intermediate Similarity NPC51345
0.822 Intermediate Similarity NPC472518
0.8205 Intermediate Similarity NPC70752
0.8198 Intermediate Similarity NPC57879
0.819 Intermediate Similarity NPC202474
0.819 Intermediate Similarity NPC100870
0.8182 Intermediate Similarity NPC234639
0.8182 Intermediate Similarity NPC469453
0.8182 Intermediate Similarity NPC472519
0.8174 Intermediate Similarity NPC101503
0.8167 Intermediate Similarity NPC474476
0.8151 Intermediate Similarity NPC60517
0.8151 Intermediate Similarity NPC89630
0.8151 Intermediate Similarity NPC146886
0.8151 Intermediate Similarity NPC20443
0.8151 Intermediate Similarity NPC246704
0.8148 Intermediate Similarity NPC8302
0.8131 Intermediate Similarity NPC298224
0.8125 Intermediate Similarity NPC165646
0.8125 Intermediate Similarity NPC266116
0.8125 Intermediate Similarity NPC280760
0.812 Intermediate Similarity NPC471877
0.812 Intermediate Similarity NPC267064
0.8108 Intermediate Similarity NPC183648
0.8108 Intermediate Similarity NPC46844
0.8108 Intermediate Similarity NPC141068
0.8103 Intermediate Similarity NPC234956
0.8099 Intermediate Similarity NPC473993
0.8099 Intermediate Similarity NPC194841
0.8095 Intermediate Similarity NPC95755
0.8087 Intermediate Similarity NPC217423
0.8087 Intermediate Similarity NPC45104
0.8087 Intermediate Similarity NPC199209
0.8087 Intermediate Similarity NPC212643
0.8083 Intermediate Similarity NPC289459
0.8083 Intermediate Similarity NPC471827
0.8083 Intermediate Similarity NPC471828
0.8067 Intermediate Similarity NPC315807
0.8067 Intermediate Similarity NPC108545
0.8067 Intermediate Similarity NPC279379
0.8056 Intermediate Similarity NPC38209
0.8051 Intermediate Similarity NPC144418
0.8049 Intermediate Similarity NPC19242
0.8049 Intermediate Similarity NPC183348
0.8049 Intermediate Similarity NPC113098
0.8049 Intermediate Similarity NPC282230
0.8037 Intermediate Similarity NPC94343
0.8036 Intermediate Similarity NPC23332
0.8036 Intermediate Similarity NPC55300
0.8034 Intermediate Similarity NPC471504
0.8034 Intermediate Similarity NPC473290
0.8034 Intermediate Similarity NPC474874
0.8034 Intermediate Similarity NPC230951
0.8034 Intermediate Similarity NPC222175
0.802 Intermediate Similarity NPC173443
0.8018 Intermediate Similarity NPC471954
0.8018 Intermediate Similarity NPC75272
0.8017 Intermediate Similarity NPC213552
0.8017 Intermediate Similarity NPC120225
0.8017 Intermediate Similarity NPC188327
0.8017 Intermediate Similarity NPC70744
0.8017 Intermediate Similarity NPC101894
0.8017 Intermediate Similarity NPC272471
0.8017 Intermediate Similarity NPC107588
0.8017 Intermediate Similarity NPC137537
0.8017 Intermediate Similarity NPC475236
0.8017 Intermediate Similarity NPC234109
0.8017 Intermediate Similarity NPC329272
0.8017 Intermediate Similarity NPC164706
0.8 Intermediate Similarity NPC281277
0.8 Intermediate Similarity NPC19290
0.8 Intermediate Similarity NPC268317
0.8 Intermediate Similarity NPC291899
0.7984 Intermediate Similarity NPC470977
0.7984 Intermediate Similarity NPC272650
0.7984 Intermediate Similarity NPC15083
0.7984 Intermediate Similarity NPC196979
0.7984 Intermediate Similarity NPC29734
0.7984 Intermediate Similarity NPC267336
0.7984 Intermediate Similarity NPC470976
0.7983 Intermediate Similarity NPC13007
0.7983 Intermediate Similarity NPC257188
0.7982 Intermediate Similarity NPC328593
0.7982 Intermediate Similarity NPC33749
0.7982 Intermediate Similarity NPC261453
0.7981 Intermediate Similarity NPC32977
0.7981 Intermediate Similarity NPC81010
0.7967 Intermediate Similarity NPC168710
0.7967 Intermediate Similarity NPC295970
0.7967 Intermediate Similarity NPC170546
0.7967 Intermediate Similarity NPC66246
0.7963 Intermediate Similarity NPC305205
0.7951 Intermediate Similarity NPC243688
0.7951 Intermediate Similarity NPC37512
0.7949 Intermediate Similarity NPC61779
0.7934 Intermediate Similarity NPC165556
0.7934 Intermediate Similarity NPC473626
0.7934 Intermediate Similarity NPC27352

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC151530 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
0.97 High Similarity NPD3134 Approved
0.9412 High Similarity NPD1358 Approved
0.8667 High Similarity NPD9697 Approved
0.8624 High Similarity NPD5535 Approved
0.8545 High Similarity NPD1241 Discontinued
0.8426 Intermediate Similarity NPD2684 Approved
0.8421 Intermediate Similarity NPD5691 Approved
0.8276 Intermediate Similarity NPD3496 Discontinued
0.8125 Intermediate Similarity NPD7843 Approved
0.8103 Intermediate Similarity NPD5585 Approved
0.8034 Intermediate Similarity NPD4626 Approved
0.8017 Intermediate Similarity NPD1894 Discontinued
0.7965 Intermediate Similarity NPD821 Approved
0.7931 Intermediate Similarity NPD5536 Phase 2
0.7913 Intermediate Similarity NPD7157 Approved
0.7899 Intermediate Similarity NPD422 Phase 1
0.7886 Intermediate Similarity NPD6832 Phase 2
0.7881 Intermediate Similarity NPD1778 Approved
0.7838 Intermediate Similarity NPD290 Approved
0.7769 Intermediate Similarity NPD4359 Approved
0.7748 Intermediate Similarity NPD968 Approved
0.7724 Intermediate Similarity NPD1019 Discontinued
0.7712 Intermediate Similarity NPD9545 Approved
0.7699 Intermediate Similarity NPD5451 Approved
0.7692 Intermediate Similarity NPD3596 Phase 2
0.7686 Intermediate Similarity NPD9717 Approved
0.768 Intermediate Similarity NPD5163 Phase 2
0.768 Intermediate Similarity NPD5746 Approved
0.7667 Intermediate Similarity NPD3847 Discontinued
0.7642 Intermediate Similarity NPD2797 Approved
0.7619 Intermediate Similarity NPD3374 Clinical (unspecified phase)
0.7619 Intermediate Similarity NPD6798 Discontinued
0.7619 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7578 Intermediate Similarity NPD4340 Discontinued
0.7563 Intermediate Similarity NPD6581 Approved
0.7563 Intermediate Similarity NPD6580 Approved
0.7559 Intermediate Similarity NPD4062 Phase 3
0.7559 Intermediate Similarity NPD6233 Phase 2
0.7559 Intermediate Similarity NPD5745 Approved
0.7541 Intermediate Similarity NPD3972 Approved
0.7524 Intermediate Similarity NPD9365 Approved
0.75 Intermediate Similarity NPD4060 Phase 1
0.75 Intermediate Similarity NPD3142 Approved
0.75 Intermediate Similarity NPD3267 Approved
0.75 Intermediate Similarity NPD4140 Approved
0.75 Intermediate Similarity NPD6830 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD3140 Approved
0.75 Intermediate Similarity NPD3266 Approved
0.748 Intermediate Similarity NPD3685 Discontinued
0.748 Intermediate Similarity NPD4379 Clinical (unspecified phase)
0.7476 Intermediate Similarity NPD1282 Approved
0.746 Intermediate Similarity NPD1008 Clinical (unspecified phase)
0.7459 Intermediate Similarity NPD1535 Discovery
0.7459 Intermediate Similarity NPD1547 Clinical (unspecified phase)
0.7458 Intermediate Similarity NPD2557 Approved
0.7444 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7442 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7442 Intermediate Similarity NPD6355 Discontinued
0.7438 Intermediate Similarity NPD17 Approved
0.7438 Intermediate Similarity NPD6516 Phase 2
0.7438 Intermediate Similarity NPD5846 Approved
0.7436 Intermediate Similarity NPD5283 Phase 1
0.7419 Intermediate Similarity NPD3225 Approved
0.7405 Intermediate Similarity NPD2799 Discontinued
0.7402 Intermediate Similarity NPD7095 Approved
0.7398 Intermediate Similarity NPD1481 Phase 2
0.7388 Intermediate Similarity NPD4628 Phase 3
0.7381 Intermediate Similarity NPD454 Approved
0.7381 Intermediate Similarity NPD2237 Approved
0.736 Intermediate Similarity NPD987 Approved
0.736 Intermediate Similarity NPD1203 Approved
0.736 Intermediate Similarity NPD6362 Approved
0.735 Intermediate Similarity NPD769 Approved
0.7344 Intermediate Similarity NPD3268 Approved
0.7339 Intermediate Similarity NPD6582 Phase 2
0.7339 Intermediate Similarity NPD5327 Phase 3
0.7339 Intermediate Similarity NPD6583 Phase 3
0.7333 Intermediate Similarity NPD3887 Approved
0.7328 Intermediate Similarity NPD7097 Phase 1
0.7323 Intermediate Similarity NPD2614 Approved
0.7317 Intermediate Similarity NPD1281 Approved
0.7317 Intermediate Similarity NPD1611 Approved
0.7311 Intermediate Similarity NPD6671 Approved
0.7308 Intermediate Similarity NPD5124 Phase 1
0.7308 Intermediate Similarity NPD1933 Approved
0.7308 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7302 Intermediate Similarity NPD5647 Approved
0.7295 Intermediate Similarity NPD2423 Clinical (unspecified phase)
0.7288 Intermediate Similarity NPD592 Approved
0.7288 Intermediate Similarity NPD594 Approved
0.7287 Intermediate Similarity NPD8032 Phase 2
0.7287 Intermediate Similarity NPD4870 Approved
0.728 Intermediate Similarity NPD1876 Approved
0.7273 Intermediate Similarity NPD1182 Approved
0.7273 Intermediate Similarity NPD1548 Phase 1
0.7265 Intermediate Similarity NPD228 Approved
0.7258 Intermediate Similarity NPD1608 Approved
0.725 Intermediate Similarity NPD9493 Approved
0.7231 Intermediate Similarity NPD2979 Phase 3
0.7231 Intermediate Similarity NPD4307 Phase 2
0.7226 Intermediate Similarity NPD6799 Approved
0.7218 Intermediate Similarity NPD4476 Approved
0.7218 Intermediate Similarity NPD2239 Approved
0.7218 Intermediate Similarity NPD2796 Approved
0.7218 Intermediate Similarity NPD2240 Approved
0.7218 Intermediate Similarity NPD4477 Approved
0.7213 Intermediate Similarity NPD2594 Approved
0.7213 Intermediate Similarity NPD3049 Approved
0.7213 Intermediate Similarity NPD1651 Approved
0.7213 Intermediate Similarity NPD3443 Approved
0.7213 Intermediate Similarity NPD3444 Approved
0.7213 Intermediate Similarity NPD2595 Approved
0.7213 Intermediate Similarity NPD3445 Approved
0.7213 Intermediate Similarity NPD1357 Approved
0.7213 Intermediate Similarity NPD6382 Discontinued
0.7209 Intermediate Similarity NPD1048 Approved
0.7209 Intermediate Similarity NPD1296 Phase 2
0.7207 Intermediate Similarity NPD1238 Approved
0.72 Intermediate Similarity NPD4129 Approved
0.72 Intermediate Similarity NPD6540 Phase 3
0.72 Intermediate Similarity NPD6542 Approved
0.72 Intermediate Similarity NPD6539 Approved
0.72 Intermediate Similarity NPD2428 Approved
0.72 Intermediate Similarity NPD6543 Approved
0.72 Intermediate Similarity NPD2429 Approved
0.7185 Intermediate Similarity NPD1652 Phase 2
0.7179 Intermediate Similarity NPD2181 Clinical (unspecified phase)
0.7177 Intermediate Similarity NPD3705 Approved
0.7176 Intermediate Similarity NPD4618 Approved
0.7176 Intermediate Similarity NPD4622 Approved
0.7165 Intermediate Similarity NPD3690 Phase 2
0.7165 Intermediate Similarity NPD6584 Phase 3
0.7165 Intermediate Similarity NPD3691 Phase 2
0.7164 Intermediate Similarity NPD5865 Clinical (unspecified phase)
0.7164 Intermediate Similarity NPD2355 Clinical (unspecified phase)
0.7164 Intermediate Similarity NPD2353 Approved
0.7156 Intermediate Similarity NPD2934 Approved
0.7156 Intermediate Similarity NPD2933 Approved
0.7155 Intermediate Similarity NPD2182 Approved
0.7154 Intermediate Similarity NPD2554 Approved
0.7154 Intermediate Similarity NPD2556 Approved
0.7153 Intermediate Similarity NPD7440 Discontinued
0.7143 Intermediate Similarity NPD6541 Approved
0.7143 Intermediate Similarity NPD6538 Approved
0.7143 Intermediate Similarity NPD1283 Approved
0.7143 Intermediate Similarity NPD3748 Approved
0.7122 Intermediate Similarity NPD6273 Approved
0.7122 Intermediate Similarity NPD7314 Clinical (unspecified phase)
0.7122 Intermediate Similarity NPD2186 Approved
0.7121 Intermediate Similarity NPD6653 Approved
0.7121 Intermediate Similarity NPD2653 Approved
0.7119 Intermediate Similarity NPD1137 Approved
0.7119 Intermediate Similarity NPD1139 Approved
0.7115 Intermediate Similarity NPD111 Approved
0.7111 Intermediate Similarity NPD4534 Discontinued
0.7109 Intermediate Similarity NPD9494 Approved
0.7109 Intermediate Similarity NPD4993 Discontinued
0.7091 Intermediate Similarity NPD2859 Approved
0.7091 Intermediate Similarity NPD2860 Approved
0.709 Intermediate Similarity NPD2935 Discontinued
0.7087 Intermediate Similarity NPD1817 Approved
0.7087 Intermediate Similarity NPD1820 Approved
0.7087 Intermediate Similarity NPD3567 Approved
0.7087 Intermediate Similarity NPD3568 Approved
0.7087 Intermediate Similarity NPD1818 Approved
0.7087 Intermediate Similarity NPD1819 Approved
0.708 Intermediate Similarity NPD291 Approved
0.7077 Intermediate Similarity NPD2313 Discontinued
0.7077 Intermediate Similarity NPD411 Approved
0.7069 Intermediate Similarity NPD5374 Approved
0.7069 Intermediate Similarity NPD5373 Approved
0.7068 Intermediate Similarity NPD5689 Approved
0.7068 Intermediate Similarity NPD5688 Approved
0.7059 Intermediate Similarity NPD1138 Approved
0.7054 Intermediate Similarity NPD4908 Phase 1
0.7054 Intermediate Similarity NPD5752 Clinical (unspecified phase)
0.7045 Intermediate Similarity NPD447 Suspended
0.704 Intermediate Similarity NPD1610 Phase 2
0.704 Intermediate Similarity NPD1091 Approved
0.7037 Intermediate Similarity NPD2343 Clinical (unspecified phase)
0.7031 Intermediate Similarity NPD7018 Phase 2
0.7031 Intermediate Similarity NPD2798 Approved
0.7023 Intermediate Similarity NPD3058 Clinical (unspecified phase)
0.7016 Intermediate Similarity NPD2667 Approved
0.7016 Intermediate Similarity NPD2668 Approved
0.7015 Intermediate Similarity NPD7033 Discontinued
0.7015 Intermediate Similarity NPD4308 Phase 3
0.7009 Intermediate Similarity NPD9295 Approved
0.7008 Intermediate Similarity NPD8651 Approved
0.7008 Intermediate Similarity NPD196 Phase 1
0.7008 Intermediate Similarity NPD7258 Clinical (unspecified phase)
0.7007 Intermediate Similarity NPD4109 Clinical (unspecified phase)
0.7007 Intermediate Similarity NPD4110 Phase 3
0.7 Intermediate Similarity NPD2598 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD3180 Approved
0.7 Intermediate Similarity NPD3165 Approved
0.7 Intermediate Similarity NPD3166 Approved
0.7 Intermediate Similarity NPD3167 Approved
0.7 Intermediate Similarity NPD3164 Approved
0.7 Intermediate Similarity NPD3179 Approved

Structure

External Identifiers

PubChem CID   71720677
ChEMBL   CHEMBL2334420
ZINC  

Physicochemical Properties

Molecular Weight:  314.19
ALogP:  3.0182
MLogP:  3.33
XLogP:  5.749
# Rotatable Bonds:  13
Polar Surface Area:  35.53
# H-Bond Aceptor:  2
# H-Bond Donor:  0
# Rings:  1
# Heavy Atoms:  23

Download Data

Data Type Select
General Info & Identifiers & Properties  
Structure MOL file  
Source Organisms  
Biological Activities  
Similar NPs/Drugs