Natural Product: NPC204535

Natural Product ID:  NPC204535
Common Name:   Sargachromano D
IUPAC Name:   (4R,5S,6E,10E)-13-[(2R)-6-hydroxy-2,8-dimethyl-3,4-dihydrochromen-2-yl]-2,6,10-trimethyltrideca-2,6,10-triene-4,5-diol
Synonyms:   Sargachromano D; Sargachromanol D
Molecular Formula:   C27H40O4
Standard InCHIKey:  YIWOAJFKIIOXPS-RYZLOPLISA-N
Standard InCHI:  InChI=1S/C27H40O4/c1-18(2)15-24(29)25(30)20(4)11-7-9-19(3)10-8-13-27(6)14-12-22-17-23(28)16-21(5)26(22)31-27/h10-11,15-17,24-25,28-30H,7-9,12-14H2,1-6H3/b19-10+,20-11+/t24-,25+,27-/m1/s1
Canonical SMILES:  C/C(=CCC[C@]1(C)CCc2c(O1)c(C)cc(c2)O)/CC/C=C(/[C@@H]([C@@H](C=C(C)C)O)O)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
NPO11479 Sargassum siliquastrum Species Sargassaceae Eukaryota PMID[15921416]
NPO11479 Sargassum siliquastrum Species Sargassaceae Eukaryota PMID[21377877]
NPO4824 Cocculus trilobus Species Menispermaceae Eukaryota UNPD*
NPO19704 Caulerpa trifaria Species Caulerpaceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT1 Others Radical scavenging activity Activity = 89.6 % 15921416
NPT1087 Individual Protein Isocitrate lyase Candida albicans IC50 > 200 ug/ml 21377877
NPT2 Others Unspecified IC50 = 3600 nM 21377877
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC > 100 ug/ml 21377877
NPT79 Organism Bacillus subtilis Bacillus subtilis MIC = 25 ug/ml 21377877
NPT729 Organism Micrococcus luteus Micrococcus luteus MIC > 100 ug/ml 21377877
NPT766 Organism Proteus vulgaris Proteus vulgaris MIC = 12.5 ug/ml 21377877
NPT566 Organism Salmonella typhimurium Salmonella enterica subsp. enterica serovar Typhimurium MIC = 25 ug/ml 21377877
NPT19 Organism Escherichia coli Escherichia coli MIC > 100 ug/ml 21377877

  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 NPC204535 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 NPC46586
0.9914 High Similarity NPC474130
0.9739 High Similarity NPC232295
0.9652 High Similarity NPC32152
0.9569 High Similarity NPC474131
0.9391 High Similarity NPC69539
0.931 High Similarity NPC238176
0.931 High Similarity NPC187993
0.916 High Similarity NPC473875
0.9113 High Similarity NPC271832
0.9113 High Similarity NPC59654
0.9068 High Similarity NPC283616
0.904 High Similarity NPC475880
0.9016 High Similarity NPC190086
0.9016 High Similarity NPC276962
0.9 High Similarity NPC45663
0.8974 High Similarity NPC473718
0.8968 High Similarity NPC474143
0.8968 High Similarity NPC474246
0.8926 High Similarity NPC48623
0.8926 High Similarity NPC168707
0.8898 High Similarity NPC154256
0.8898 High Similarity NPC290470
0.8862 High Similarity NPC474237
0.8862 High Similarity NPC147896
0.875 High Similarity NPC27578
0.875 High Similarity NPC139047
0.875 High Similarity NPC289624
0.8718 High Similarity NPC474920
0.8699 High Similarity NPC302211
0.8689 High Similarity NPC475529
0.8678 High Similarity NPC51341
0.8661 High Similarity NPC97326
0.8629 High Similarity NPC261992
0.856 High Similarity NPC61685
0.8559 High Similarity NPC98372
0.8548 High Similarity NPC188997
0.8538 High Similarity NPC211352
0.8527 High Similarity NPC153019
0.8525 High Similarity NPC471449
0.8519 High Similarity NPC474154
0.8504 High Similarity NPC473993
0.85 High Similarity NPC301321
0.8492 Intermediate Similarity NPC477213
0.8485 Intermediate Similarity NPC472800
0.8462 Intermediate Similarity NPC329427
0.8462 Intermediate Similarity NPC317601
0.845 Intermediate Similarity NPC11089
0.8448 Intermediate Similarity NPC233320
0.843 Intermediate Similarity NPC242580
0.843 Intermediate Similarity NPC236070
0.843 Intermediate Similarity NPC126759
0.8413 Intermediate Similarity NPC248557
0.8385 Intermediate Similarity NPC103799
0.8372 Intermediate Similarity NPC472796
0.8372 Intermediate Similarity NPC472795
0.8372 Intermediate Similarity NPC158477
0.8359 Intermediate Similarity NPC319422
0.8359 Intermediate Similarity NPC477214
0.8359 Intermediate Similarity NPC477212
0.8359 Intermediate Similarity NPC142087
0.8359 Intermediate Similarity NPC95034
0.8359 Intermediate Similarity NPC477211
0.8346 Intermediate Similarity NPC476254
0.8346 Intermediate Similarity NPC470726
0.8346 Intermediate Similarity NPC131397
0.8346 Intermediate Similarity NPC470802
0.8346 Intermediate Similarity NPC475628
0.8333 Intermediate Similarity NPC477210
0.8333 Intermediate Similarity NPC16485
0.8321 Intermediate Similarity NPC18842
0.832 Intermediate Similarity NPC476165
0.8319 Intermediate Similarity NPC275627
0.8308 Intermediate Similarity NPC470727
0.8308 Intermediate Similarity NPC196621
0.8308 Intermediate Similarity NPC262606
0.8308 Intermediate Similarity NPC220935
0.8305 Intermediate Similarity NPC473524
0.8295 Intermediate Similarity NPC40377
0.8295 Intermediate Similarity NPC38604
0.8295 Intermediate Similarity NPC211179
0.8295 Intermediate Similarity NPC47288
0.8295 Intermediate Similarity NPC274717
0.8281 Intermediate Similarity NPC470724
0.8271 Intermediate Similarity NPC475029
0.8271 Intermediate Similarity NPC473413
0.8271 Intermediate Similarity NPC476018
0.824 Intermediate Similarity NPC129176
0.824 Intermediate Similarity NPC96423
0.8231 Intermediate Similarity NPC472797
0.8226 Intermediate Similarity NPC163036
0.822 Intermediate Similarity NPC241549
0.8217 Intermediate Similarity NPC469386
0.8209 Intermediate Similarity NPC29799
0.8209 Intermediate Similarity NPC10737
0.8209 Intermediate Similarity NPC472336
0.8209 Intermediate Similarity NPC54743
0.8209 Intermediate Similarity NPC472334
0.8209 Intermediate Similarity NPC327735
0.8209 Intermediate Similarity NPC156502
0.8209 Intermediate Similarity NPC263367
0.8209 Intermediate Similarity NPC209985
0.8209 Intermediate Similarity NPC177160
0.8209 Intermediate Similarity NPC477939
0.8203 Intermediate Similarity NPC81641
0.8203 Intermediate Similarity NPC133407
0.8203 Intermediate Similarity NPC28476
0.8195 Intermediate Similarity NPC124085
0.8195 Intermediate Similarity NPC193026
0.8195 Intermediate Similarity NPC187616
0.8195 Intermediate Similarity NPC49603
0.8195 Intermediate Similarity NPC117048
0.8188 Intermediate Similarity NPC63879
0.8188 Intermediate Similarity NPC50250
0.8182 Intermediate Similarity NPC51262
0.8175 Intermediate Similarity NPC290451
0.8175 Intermediate Similarity NPC127389
0.8175 Intermediate Similarity NPC475839
0.8168 Intermediate Similarity NPC325003
0.8168 Intermediate Similarity NPC143483
0.8162 Intermediate Similarity NPC259519
0.8162 Intermediate Similarity NPC473049
0.8162 Intermediate Similarity NPC472794
0.8154 Intermediate Similarity NPC472968
0.8154 Intermediate Similarity NPC87224
0.8154 Intermediate Similarity NPC222572
0.8148 Intermediate Similarity NPC107551
0.8148 Intermediate Similarity NPC176051
0.8148 Intermediate Similarity NPC474282
0.8148 Intermediate Similarity NPC102904
0.8148 Intermediate Similarity NPC103976
0.8148 Intermediate Similarity NPC326797
0.8145 Intermediate Similarity NPC329980
0.8145 Intermediate Similarity NPC206205
0.8143 Intermediate Similarity NPC101376
0.814 Intermediate Similarity NPC276212
0.814 Intermediate Similarity NPC476006
0.814 Intermediate Similarity NPC178284
0.814 Intermediate Similarity NPC58607
0.814 Intermediate Similarity NPC191037
0.8136 Intermediate Similarity NPC474352
0.8136 Intermediate Similarity NPC194034
0.8134 Intermediate Similarity NPC260898
0.8134 Intermediate Similarity NPC472337
0.8134 Intermediate Similarity NPC475011
0.8134 Intermediate Similarity NPC151224
0.8134 Intermediate Similarity NPC47398
0.8134 Intermediate Similarity NPC164787
0.8134 Intermediate Similarity NPC61946
0.8134 Intermediate Similarity NPC234333
0.8134 Intermediate Similarity NPC134968
0.8129 Intermediate Similarity NPC472457
0.8129 Intermediate Similarity NPC90645
0.8125 Intermediate Similarity NPC48990
0.8125 Intermediate Similarity NPC114901
0.8125 Intermediate Similarity NPC109822
0.8125 Intermediate Similarity NPC94276
0.8125 Intermediate Similarity NPC293701
0.812 Intermediate Similarity NPC26394
0.812 Intermediate Similarity NPC85435
0.812 Intermediate Similarity NPC92805
0.812 Intermediate Similarity NPC11060
0.8116 Intermediate Similarity NPC102044
0.8116 Intermediate Similarity NPC47633
0.8116 Intermediate Similarity NPC85264
0.8115 Intermediate Similarity NPC161696
0.8115 Intermediate Similarity NPC474050
0.8115 Intermediate Similarity NPC474114
0.8115 Intermediate Similarity NPC473931
0.8115 Intermediate Similarity NPC470837
0.811 Intermediate Similarity NPC150026
0.811 Intermediate Similarity NPC120638
0.811 Intermediate Similarity NPC49441
0.8106 Intermediate Similarity NPC181497
0.8106 Intermediate Similarity NPC271945
0.8103 Intermediate Similarity NPC108497
0.8102 Intermediate Similarity NPC471389
0.8095 Intermediate Similarity NPC207613
0.8095 Intermediate Similarity NPC212559
0.8092 Intermediate Similarity NPC86030
0.8092 Intermediate Similarity NPC93962
0.8092 Intermediate Similarity NPC5851
0.8088 Intermediate Similarity NPC475836
0.8088 Intermediate Similarity NPC32630
0.8088 Intermediate Similarity NPC19869
0.8088 Intermediate Similarity NPC471388
0.8083 Intermediate Similarity NPC46844
0.808 Intermediate Similarity NPC24474
0.808 Intermediate Similarity NPC311595
0.8077 Intermediate Similarity NPC183181
0.8077 Intermediate Similarity NPC163332
0.8077 Intermediate Similarity NPC111247
0.8077 Intermediate Similarity NPC292056
0.8077 Intermediate Similarity NPC319625
0.8077 Intermediate Similarity NPC41706
0.8077 Intermediate Similarity NPC147821
0.8077 Intermediate Similarity NPC118787
0.8074 Intermediate Similarity NPC16435
0.8074 Intermediate Similarity NPC227503
0.8074 Intermediate Similarity NPC476698

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC204535 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
0.9138 High Similarity NPD6671 Approved
0.843 Intermediate Similarity NPD7340 Approved
0.8333 Intermediate Similarity NPD1398 Phase 1
0.8268 Intermediate Similarity NPD6696 Suspended
0.8217 Intermediate Similarity NPD2861 Phase 2
0.8168 Intermediate Similarity NPD6410 Clinical (unspecified phase)
0.8136 Intermediate Similarity NPD290 Approved
0.8099 Intermediate Similarity NPD7843 Approved
0.8095 Intermediate Similarity NPD3496 Discontinued
0.8067 Intermediate Similarity NPD2684 Approved
0.8051 Intermediate Similarity NPD968 Approved
0.8049 Intermediate Similarity NPD7157 Approved
0.8045 Intermediate Similarity NPD4060 Phase 1
0.791 Intermediate Similarity NPD1613 Approved
0.791 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.7907 Intermediate Similarity NPD4749 Approved
0.7895 Intermediate Similarity NPD7985 Registered
0.7891 Intermediate Similarity NPD1091 Approved
0.7846 Intermediate Similarity NPD8651 Approved
0.7842 Intermediate Similarity NPD5698 Clinical (unspecified phase)
0.782 Intermediate Similarity NPD4625 Phase 3
0.777 Intermediate Similarity NPD2424 Discontinued
0.7769 Intermediate Similarity NPD3600 Clinical (unspecified phase)
0.7761 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7698 Intermediate Similarity NPD5763 Approved
0.7698 Intermediate Similarity NPD5762 Approved
0.7692 Intermediate Similarity NPD2235 Phase 2
0.7692 Intermediate Similarity NPD2231 Phase 2
0.7687 Intermediate Similarity NPD3027 Phase 3
0.7669 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7638 Intermediate Similarity NPD7644 Approved
0.7615 Intermediate Similarity NPD1611 Approved
0.7612 Intermediate Similarity NPD4908 Phase 1
0.7612 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7609 Intermediate Similarity NPD4537 Clinical (unspecified phase)
0.7609 Intermediate Similarity NPD4538 Approved
0.7609 Intermediate Similarity NPD4536 Approved
0.7594 Intermediate Similarity NPD6917 Clinical (unspecified phase)
0.7591 Intermediate Similarity NPD5735 Approved
0.7589 Intermediate Similarity NPD6674 Discontinued
0.7581 Intermediate Similarity NPD228 Approved
0.7536 Intermediate Similarity NPD6653 Approved
0.7535 Intermediate Similarity NPD7982 Clinical (unspecified phase)
0.752 Intermediate Similarity NPD7635 Approved
0.7517 Intermediate Similarity NPD6090 Discontinued
0.7482 Intermediate Similarity NPD7097 Phase 1
0.7481 Intermediate Similarity NPD1610 Phase 2
0.7479 Intermediate Similarity NPD289 Clinical (unspecified phase)
0.7464 Intermediate Similarity NPD6355 Discontinued
0.7463 Intermediate Similarity NPD3690 Phase 2
0.7463 Intermediate Similarity NPD3691 Phase 2
0.7463 Intermediate Similarity NPD6584 Phase 3
0.7462 Intermediate Similarity NPD4626 Approved
0.7429 Intermediate Similarity NPD5588 Approved
0.7429 Intermediate Similarity NPD5960 Phase 3
0.7426 Intermediate Similarity NPD7095 Approved
0.7424 Intermediate Similarity NPD2232 Approved
0.7424 Intermediate Similarity NPD2233 Approved
0.7424 Intermediate Similarity NPD2230 Approved
0.74 Intermediate Similarity NPD5929 Approved
0.7397 Intermediate Similarity NPD2676 Approved
0.7397 Intermediate Similarity NPD2675 Approved
0.7391 Intermediate Similarity NPD3620 Phase 2
0.7391 Intermediate Similarity NPD3619 Clinical (unspecified phase)
0.7385 Intermediate Similarity NPD5691 Approved
0.7376 Intermediate Similarity NPD6032 Approved
0.7376 Intermediate Similarity NPD2935 Discontinued
0.7372 Intermediate Similarity NPD6798 Discontinued
0.7368 Intermediate Similarity NPD5327 Phase 3
0.7353 Intermediate Similarity NPD596 Approved
0.7353 Intermediate Similarity NPD600 Approved
0.7338 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7338 Intermediate Similarity NPD5124 Phase 1
0.7328 Intermediate Similarity NPD6516 Phase 2
0.7328 Intermediate Similarity NPD5846 Approved
0.7328 Intermediate Similarity NPD1778 Approved
0.7323 Intermediate Similarity NPD5283 Phase 1
0.7319 Intermediate Similarity NPD839 Approved
0.7319 Intermediate Similarity NPD6233 Phase 2
0.7319 Intermediate Similarity NPD840 Approved
0.731 Intermediate Similarity NPD5058 Phase 3
0.7308 Intermediate Similarity NPD1548 Phase 1
0.7292 Intermediate Similarity NPD4535 Phase 3
0.7292 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7288 Intermediate Similarity NPD844 Approved
0.7286 Intermediate Similarity NPD6353 Approved
0.7285 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.7279 Intermediate Similarity NPD2237 Approved
0.7266 Intermediate Similarity NPD4140 Approved
0.7266 Intermediate Similarity NPD2238 Phase 2
0.7254 Intermediate Similarity NPD6099 Approved
0.7254 Intermediate Similarity NPD6100 Approved
0.7244 Intermediate Similarity NPD821 Approved
0.7241 Intermediate Similarity NPD2677 Approved
0.7239 Intermediate Similarity NPD6582 Phase 2
0.7239 Intermediate Similarity NPD6583 Phase 3
0.7239 Intermediate Similarity NPD3685 Discontinued
0.7218 Intermediate Similarity NPD776 Approved
0.7209 Intermediate Similarity NPD2557 Approved
0.7206 Intermediate Similarity NPD558 Phase 2
0.7203 Intermediate Similarity NPD6006 Clinical (unspecified phase)
0.7203 Intermediate Similarity NPD6003 Clinical (unspecified phase)
0.7203 Intermediate Similarity NPD6005 Phase 3
0.7203 Intermediate Similarity NPD6002 Phase 3
0.7203 Intermediate Similarity NPD6004 Phase 3
0.7183 Intermediate Similarity NPD2155 Approved
0.7183 Intermediate Similarity NPD2154 Approved
0.7183 Intermediate Similarity NPD7033 Discontinued
0.7183 Intermediate Similarity NPD2156 Approved
0.7181 Intermediate Similarity NPD1653 Approved
0.7163 Intermediate Similarity NPD2157 Approved
0.7153 Intermediate Similarity NPD1712 Approved
0.7143 Intermediate Similarity NPD3022 Approved
0.7143 Intermediate Similarity NPD3597 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD7041 Phase 2
0.7143 Intermediate Similarity NPD3021 Approved
0.7143 Intermediate Similarity NPD7040 Clinical (unspecified phase)
0.7132 Intermediate Similarity NPD1794 Approved
0.7131 Intermediate Similarity NPD291 Approved
0.7122 Intermediate Similarity NPD1699 Clinical (unspecified phase)
0.7121 Intermediate Similarity NPD3444 Approved
0.7121 Intermediate Similarity NPD3445 Approved
0.7121 Intermediate Similarity NPD3443 Approved
0.7121 Intermediate Similarity NPD6382 Discontinued
0.7121 Intermediate Similarity NPD1357 Approved
0.7121 Intermediate Similarity NPD5585 Approved
0.7119 Intermediate Similarity NPD845 Approved
0.7111 Intermediate Similarity NPD4379 Clinical (unspecified phase)
0.7109 Intermediate Similarity NPD5535 Approved
0.7109 Intermediate Similarity NPD1138 Approved
0.7105 Intermediate Similarity NPD4433 Discontinued
0.7103 Intermediate Similarity NPD5061 Approved
0.7103 Intermediate Similarity NPD5177 Phase 3
0.7103 Intermediate Similarity NPD5062 Approved
0.7095 Intermediate Similarity NPD7446 Clinical (unspecified phase)
0.7094 Intermediate Similarity NPD9365 Approved
0.709 Intermediate Similarity NPD1535 Discovery
0.7083 Intermediate Similarity NPD288 Approved
0.7077 Intermediate Similarity NPD6387 Discontinued
0.7071 Intermediate Similarity NPD3162 Approved
0.7071 Intermediate Similarity NPD7477 Discontinued
0.7071 Intermediate Similarity NPD3163 Approved
0.7069 Intermediate Similarity NPD9295 Approved
0.7055 Intermediate Similarity NPD7976 Clinical (unspecified phase)
0.7054 Intermediate Similarity NPD7159 Clinical (unspecified phase)
0.7054 Intermediate Similarity NPD594 Approved
0.7054 Intermediate Similarity NPD592 Approved
0.7037 Intermediate Similarity NPD1481 Phase 2
0.7031 Intermediate Similarity NPD6124 Clinical (unspecified phase)
0.7031 Intermediate Similarity NPD1139 Approved
0.7031 Intermediate Similarity NPD1137 Approved
0.7027 Intermediate Similarity NPD1774 Approved
0.7021 Intermediate Similarity NPD5837 Clinical (unspecified phase)
0.702 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7013 Intermediate Similarity NPD2415 Discontinued
0.7008 Intermediate Similarity NPD4750 Phase 3
0.7007 Intermediate Similarity NPD3094 Phase 2
0.7007 Intermediate Similarity NPD4098 Discontinued
0.7007 Intermediate Similarity NPD6362 Approved
0.7007 Intermediate Similarity NPD2797 Approved
0.7 Intermediate Similarity NPD2860 Approved
0.7 Intermediate Similarity NPD2859 Approved
0.7 Intermediate Similarity NPD1809 Phase 2
0.7 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.6993 Remote Similarity NPD1934 Approved
0.6993 Remote Similarity NPD6844 Discontinued
0.6992 Remote Similarity NPD3049 Approved
0.6986 Remote Similarity NPD1652 Phase 2
0.698 Remote Similarity NPD1754 Clinical (unspecified phase)
0.698 Remote Similarity NPD7004 Clinical (unspecified phase)
0.6974 Remote Similarity NPD4380 Phase 2
0.6967 Remote Similarity NPD3020 Approved
0.6966 Remote Similarity NPD7030 Discontinued
0.6966 Remote Similarity NPD2346 Discontinued
0.6963 Remote Similarity NPD3092 Approved
0.6963 Remote Similarity NPD422 Phase 1
0.6963 Remote Similarity NPD3705 Approved
0.6959 Remote Similarity NPD6667 Approved
0.6959 Remote Similarity NPD6666 Approved
0.6959 Remote Similarity NPD3122 Phase 3
0.6957 Remote Similarity NPD5647 Approved
0.6957 Remote Similarity NPD4624 Approved
0.695 Remote Similarity NPD4062 Phase 3
0.6948 Remote Similarity NPD8455 Phase 2
0.6947 Remote Similarity NPD709 Approved
0.6944 Remote Similarity NPD3846 Clinical (unspecified phase)
0.6943 Remote Similarity NPD4666 Phase 3
0.694 Remote Similarity NPD2554 Approved
0.694 Remote Similarity NPD2668 Approved
0.694 Remote Similarity NPD2667 Approved
0.694 Remote Similarity NPD2556 Approved
0.6939 Remote Similarity NPD6331 Phase 2
0.6939 Remote Similarity NPD4628 Phase 3
0.6939 Remote Similarity NPD7835 Discontinued
0.6928 Remote Similarity NPD6072 Discontinued
0.6923 Remote Similarity NPD4097 Suspended
0.6923 Remote Similarity NPD7075 Discontinued
0.6923 Remote Similarity NPD3453 Discontinued
0.6917 Remote Similarity NPD1182 Approved
0.6917 Remote Similarity NPD2933 Approved

Structure

External Identifiers

PubChem CID   11247397
ChEMBL   CHEMBL465202
ZINC  

Physicochemical Properties

Molecular Weight:  428.29
ALogP:  3.6926
MLogP:  3.99
XLogP:  4.928
# Rotatable Bonds:  18
Polar Surface Area:  69.92
# H-Bond Aceptor:  2
# H-Bond Donor:  3
# Rings:  2
# Heavy Atoms:  31

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