Natural Product: NPC271104

Natural Product ID:  NPC271104
Common Name:   (1R,6S,7R,8S)-(-)-8-Hydroxysclerosporin
IUPAC Name:   (3S,4R,4aS,8aR)-3-hydroxy-6-methyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydronaphthalene-1-carboxylic acid
Synonyms:   8-hydroxysclerosporin
Molecular Formula:   C15H22O3
Standard InCHIKey:  ZLYNIGWZDMTJTK-ZMJPVWNMSA-N
Standard InCHI:  InChI=1S/C15H22O3/c1-8(2)14-11-6-9(3)4-5-10(11)12(15(17)18)7-13(14)16/h6-8,10-11,13-14,16H,4-5H2,1-3H3,(H,17,18)/t10-,11+,13-,14-/m1/s1
Canonical SMILES:  CC1=C[C@H]2[C@@H](CC1)C(=C[C@H]([C@@H]2C(C)C)O)C(=O)O
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
NPO22368 Sciadocephala schultze-rhonhofiae NA NA NA UNPD*
NPO20957 Foetidia africana Species Lecythidaceae Eukaryota UNPD*
NPO20136 Cadophora malorum Species NA Eukaryota UNPD*
NPO19960 Schnabelia tetradonta Species Lamiaceae Eukaryota UNPD*
NPO13107 Rumex patientia Species Polygonaceae Eukaryota UNPD*
NPO22627 Streptomyces pluricolorescens Species Streptomycetaceae Bacteria UNPD*
NPO29174.1 Senna macranthera var. micans Varieties Fabaceae Eukaryota UNPD*
NPO21465 Crepis multicaulis Species Asteraceae Eukaryota UNPD*
NPO22885 Croton lacciferus Species Euphorbiaceae Eukaryota UNPD*
NPO22949 Verbesina myriocephala Species Asteraceae Eukaryota UNPD*
NPO20579 Seiridium unicorne Species Sporocadaceae Eukaryota UNPD*
NPO20321 Oreopanax guatemalensis Species Araliaceae Eukaryota UNPD*
NPO20136 Cadophora malorum Species NA Eukaryota isolated from the green alga Enteromorpha sp. PMID[20052971]
NPO1784 Paraburkholderia andropogonis Species Burkholderiaceae Bacteria UNPD*
NPO20452 Malbranchea pulchella Species NA Eukaryota UNPD*
NPO21527 Vaccinium dunalianum Species Ericaceae Eukaryota UNPD*
NPO22431 Lessonia nigrescens Species Lessoniaceae Eukaryota UNPD*
NPO19885 Propionibacterium freudenreichii Species Propionibacteriaceae Bacteria UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT520 Cell Line 3T3-L1 Mus musculus IC50 = 53 ug/ml 20052971
NPT520 Cell Line 3T3-L1 Mus musculus IC50 = 76 ug/ml 20052971
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 26 % 20052971
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 133 % 20052971
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 117 % 20052971
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 46 % 20052971
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 79 % 20052971
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 82 % 20052971

  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 NPC271104 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
0.9024 High Similarity NPC249889
0.9024 High Similarity NPC193843
0.8916 High Similarity NPC310236
0.88 High Similarity NPC35656
0.8642 High Similarity NPC49019
0.8608 High Similarity NPC308038
0.859 High Similarity NPC97377
0.8571 High Similarity NPC476795
0.8537 High Similarity NPC472326
0.85 High Similarity NPC472301
0.8481 Intermediate Similarity NPC74410
0.8481 Intermediate Similarity NPC62336
0.8481 Intermediate Similarity NPC475994
0.8471 Intermediate Similarity NPC214387
0.8462 Intermediate Similarity NPC470525
0.8462 Intermediate Similarity NPC263582
0.8452 Intermediate Similarity NPC312561
0.8415 Intermediate Similarity NPC297398
0.8391 Intermediate Similarity NPC115021
0.8378 Intermediate Similarity NPC472875
0.8375 Intermediate Similarity NPC19900
0.8372 Intermediate Similarity NPC477147
0.8372 Intermediate Similarity NPC477149
0.8354 Intermediate Similarity NPC74995
0.8353 Intermediate Similarity NPC104560
0.8333 Intermediate Similarity NPC472974
0.8333 Intermediate Similarity NPC82979
0.8333 Intermediate Similarity NPC473226
0.8333 Intermediate Similarity NPC194417
0.8315 Intermediate Similarity NPC472941
0.8315 Intermediate Similarity NPC456
0.8313 Intermediate Similarity NPC165064
0.8293 Intermediate Similarity NPC224455
0.8293 Intermediate Similarity NPC158411
0.8293 Intermediate Similarity NPC93590
0.8293 Intermediate Similarity NPC38796
0.8272 Intermediate Similarity NPC172013
0.8256 Intermediate Similarity NPC5509
0.825 Intermediate Similarity NPC172066
0.825 Intermediate Similarity NPC198240
0.825 Intermediate Similarity NPC239098
0.8243 Intermediate Similarity NPC166791
0.8243 Intermediate Similarity NPC322035
0.8243 Intermediate Similarity NPC100719
0.8228 Intermediate Similarity NPC472305
0.8214 Intermediate Similarity NPC52628
0.8214 Intermediate Similarity NPC476426
0.8205 Intermediate Similarity NPC213223
0.8193 Intermediate Similarity NPC97913
0.8193 Intermediate Similarity NPC57370
0.8171 Intermediate Similarity NPC473420
0.8171 Intermediate Similarity NPC6663
0.8161 Intermediate Similarity NPC232426
0.8161 Intermediate Similarity NPC281942
0.8148 Intermediate Similarity NPC281138
0.8148 Intermediate Similarity NPC152061
0.814 Intermediate Similarity NPC473229
0.814 Intermediate Similarity NPC72397
0.8132 Intermediate Similarity NPC478056
0.8132 Intermediate Similarity NPC197386
0.8132 Intermediate Similarity NPC166745
0.8132 Intermediate Similarity NPC235464
0.8125 Intermediate Similarity NPC34110
0.8125 Intermediate Similarity NPC61952
0.8125 Intermediate Similarity NPC197659
0.8118 Intermediate Similarity NPC322159
0.8101 Intermediate Similarity NPC472327
0.8101 Intermediate Similarity NPC114236
0.8095 Intermediate Similarity NPC30486
0.8095 Intermediate Similarity NPC164577
0.8095 Intermediate Similarity NPC476412
0.8095 Intermediate Similarity NPC472865
0.8095 Intermediate Similarity NPC302360
0.8077 Intermediate Similarity NPC186042
0.8072 Intermediate Similarity NPC73882
0.8068 Intermediate Similarity NPC141831
0.8068 Intermediate Similarity NPC177037
0.8068 Intermediate Similarity NPC472814
0.8049 Intermediate Similarity NPC157895
0.8049 Intermediate Similarity NPC104120
0.8049 Intermediate Similarity NPC45495
0.8049 Intermediate Similarity NPC148685
0.8046 Intermediate Similarity NPC472983
0.8046 Intermediate Similarity NPC168131
0.8046 Intermediate Similarity NPC281524
0.8046 Intermediate Similarity NPC123912
0.8043 Intermediate Similarity NPC287833
0.8025 Intermediate Similarity NPC169095
0.8025 Intermediate Similarity NPC59436
0.8025 Intermediate Similarity NPC253561
0.8025 Intermediate Similarity NPC179028
0.8025 Intermediate Similarity NPC80088
0.8025 Intermediate Similarity NPC192006
0.8 Intermediate Similarity NPC109528
0.8 Intermediate Similarity NPC7629
0.8 Intermediate Similarity NPC474083
0.8 Intermediate Similarity NPC179006
0.8 Intermediate Similarity NPC151622
0.8 Intermediate Similarity NPC174948
0.8 Intermediate Similarity NPC180886
0.8 Intermediate Similarity NPC474853
0.8 Intermediate Similarity NPC19907
0.8 Intermediate Similarity NPC476174
0.8 Intermediate Similarity NPC183012
0.8 Intermediate Similarity NPC173875
0.8 Intermediate Similarity NPC469995
0.8 Intermediate Similarity NPC106416
0.8 Intermediate Similarity NPC318282
0.8 Intermediate Similarity NPC86316
0.7976 Intermediate Similarity NPC66764
0.7976 Intermediate Similarity NPC215893
0.7976 Intermediate Similarity NPC110150
0.7975 Intermediate Similarity NPC301065
0.7957 Intermediate Similarity NPC472924
0.7952 Intermediate Similarity NPC278459
0.7952 Intermediate Similarity NPC90055
0.7952 Intermediate Similarity NPC470298
0.7952 Intermediate Similarity NPC116797
0.7935 Intermediate Similarity NPC23364
0.7935 Intermediate Similarity NPC471717
0.7931 Intermediate Similarity NPC472870
0.7931 Intermediate Similarity NPC48107
0.7931 Intermediate Similarity NPC24816
0.7927 Intermediate Similarity NPC7232
0.7912 Intermediate Similarity NPC328371
0.7912 Intermediate Similarity NPC301534
0.7912 Intermediate Similarity NPC250757
0.7907 Intermediate Similarity NPC472985
0.7907 Intermediate Similarity NPC472869
0.7907 Intermediate Similarity NPC472986
0.7907 Intermediate Similarity NPC198761
0.7901 Intermediate Similarity NPC203403
0.7901 Intermediate Similarity NPC471061
0.7901 Intermediate Similarity NPC165711
0.7901 Intermediate Similarity NPC266193
0.7901 Intermediate Similarity NPC257666
0.7889 Intermediate Similarity NPC53685
0.7889 Intermediate Similarity NPC469406
0.7882 Intermediate Similarity NPC472864
0.7882 Intermediate Similarity NPC248758
0.7882 Intermediate Similarity NPC473246
0.7882 Intermediate Similarity NPC470812
0.7882 Intermediate Similarity NPC19849
0.7875 Intermediate Similarity NPC476346
0.7872 Intermediate Similarity NPC293753
0.7865 Intermediate Similarity NPC186363
0.7865 Intermediate Similarity NPC233345
0.7865 Intermediate Similarity NPC252433
0.7865 Intermediate Similarity NPC303697
0.7865 Intermediate Similarity NPC212948
0.7857 Intermediate Similarity NPC103486
0.7849 Intermediate Similarity NPC51370
0.7849 Intermediate Similarity NPC476274
0.7849 Intermediate Similarity NPC241221
0.7848 Intermediate Similarity NPC109576
0.7848 Intermediate Similarity NPC56747
0.7848 Intermediate Similarity NPC275098
0.7848 Intermediate Similarity NPC180015
0.7848 Intermediate Similarity NPC130016
0.7841 Intermediate Similarity NPC118011
0.7841 Intermediate Similarity NPC477973
0.7841 Intermediate Similarity NPC472240
0.7841 Intermediate Similarity NPC309603
0.7841 Intermediate Similarity NPC473999
0.7841 Intermediate Similarity NPC146554
0.7841 Intermediate Similarity NPC472973
0.7841 Intermediate Similarity NPC314727
0.7841 Intermediate Similarity NPC155479
0.7841 Intermediate Similarity NPC36668
0.7841 Intermediate Similarity NPC262858
0.7841 Intermediate Similarity NPC174342
0.7831 Intermediate Similarity NPC2482
0.7831 Intermediate Similarity NPC281880
0.7831 Intermediate Similarity NPC471514
0.7826 Intermediate Similarity NPC253826
0.7826 Intermediate Similarity NPC320306
0.7821 Intermediate Similarity NPC235586
0.7816 Intermediate Similarity NPC71507
0.7816 Intermediate Similarity NPC312215
0.7816 Intermediate Similarity NPC476409
0.7816 Intermediate Similarity NPC233836
0.7816 Intermediate Similarity NPC159046
0.7816 Intermediate Similarity NPC287079
0.7816 Intermediate Similarity NPC187376
0.7805 Intermediate Similarity NPC297996
0.7805 Intermediate Similarity NPC275494
0.7805 Intermediate Similarity NPC247783
0.7805 Intermediate Similarity NPC269543
0.7805 Intermediate Similarity NPC321514
0.7805 Intermediate Similarity NPC471409
0.7791 Intermediate Similarity NPC474537
0.7791 Intermediate Similarity NPC28887
0.7791 Intermediate Similarity NPC471224
0.7791 Intermediate Similarity NPC274724
0.7791 Intermediate Similarity NPC70685
0.7791 Intermediate Similarity NPC15807
0.7791 Intermediate Similarity NPC189311
0.7791 Intermediate Similarity NPC65661
0.7778 Intermediate Similarity NPC109305
0.7778 Intermediate Similarity NPC473223

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC271104 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
0.7674 Intermediate Similarity NPD3665 Phase 1
0.7674 Intermediate Similarity NPD3666 Approved
0.7674 Intermediate Similarity NPD3133 Approved
0.7667 Intermediate Similarity NPD7515 Phase 2
0.7582 Intermediate Similarity NPD5778 Approved
0.7582 Intermediate Similarity NPD5779 Approved
0.75 Intermediate Similarity NPD3618 Phase 1
0.75 Intermediate Similarity NPD5279 Phase 3
0.7442 Intermediate Similarity NPD4752 Clinical (unspecified phase)
0.7442 Intermediate Similarity NPD3667 Approved
0.7386 Intermediate Similarity NPD1694 Approved
0.7386 Intermediate Similarity NPD5363 Approved
0.7312 Intermediate Similarity NPD7748 Approved
0.7303 Intermediate Similarity NPD4623 Approved
0.7303 Intermediate Similarity NPD5330 Approved
0.7303 Intermediate Similarity NPD4519 Discontinued
0.7303 Intermediate Similarity NPD7521 Approved
0.7303 Intermediate Similarity NPD7334 Approved
0.7303 Intermediate Similarity NPD6409 Approved
0.7303 Intermediate Similarity NPD6684 Approved
0.7303 Intermediate Similarity NPD7146 Approved
0.7283 Intermediate Similarity NPD6079 Approved
0.7273 Intermediate Similarity NPD4786 Approved
0.7253 Intermediate Similarity NPD5764 Clinical (unspecified phase)
0.7253 Intermediate Similarity NPD6101 Approved
0.7253 Intermediate Similarity NPD5328 Approved
0.7234 Intermediate Similarity NPD5695 Phase 3
0.7209 Intermediate Similarity NPD4695 Discontinued
0.7176 Intermediate Similarity NPD5784 Clinical (unspecified phase)
0.7159 Intermediate Similarity NPD5362 Discontinued
0.7143 Intermediate Similarity NPD6903 Approved
0.7143 Intermediate Similarity NPD7513 Clinical (unspecified phase)
0.7113 Intermediate Similarity NPD7640 Approved
0.7113 Intermediate Similarity NPD7639 Approved
0.7113 Intermediate Similarity NPD6404 Discontinued
0.7111 Intermediate Similarity NPD5690 Phase 2
0.7097 Intermediate Similarity NPD6411 Approved
0.7097 Intermediate Similarity NPD5281 Approved
0.7097 Intermediate Similarity NPD5284 Approved
0.7083 Intermediate Similarity NPD6084 Phase 2
0.7083 Intermediate Similarity NPD6083 Phase 2
0.7083 Intermediate Similarity NPD7902 Approved
0.7065 Intermediate Similarity NPD7285 Clinical (unspecified phase)
0.7065 Intermediate Similarity NPD4753 Phase 2
0.7045 Intermediate Similarity NPD4223 Phase 3
0.7045 Intermediate Similarity NPD4269 Approved
0.7045 Intermediate Similarity NPD4221 Approved
0.7045 Intermediate Similarity NPD4270 Approved
0.7021 Intermediate Similarity NPD4202 Approved
0.7021 Intermediate Similarity NPD6399 Phase 3
0.7013 Intermediate Similarity NPD368 Approved
0.701 Intermediate Similarity NPD4225 Approved
0.701 Intermediate Similarity NPD7638 Approved
0.7 Intermediate Similarity NPD1696 Phase 3
0.6989 Remote Similarity NPD5785 Approved
0.6979 Remote Similarity NPD5222 Approved
0.6979 Remote Similarity NPD5221 Approved
0.6979 Remote Similarity NPD5220 Clinical (unspecified phase)
0.697 Remote Similarity NPD5211 Phase 2
0.6966 Remote Similarity NPD7154 Phase 3
0.6957 Remote Similarity NPD5737 Approved
0.6957 Remote Similarity NPD6672 Approved
0.6923 Remote Similarity NPD4694 Approved
0.6923 Remote Similarity NPD5280 Approved
0.6907 Remote Similarity NPD5173 Approved
0.6892 Remote Similarity NPD342 Phase 1
0.6889 Remote Similarity NPD4197 Approved
0.6875 Remote Similarity NPD7331 Phase 2
0.6875 Remote Similarity NPD5210 Approved
0.6875 Remote Similarity NPD4629 Approved
0.6863 Remote Similarity NPD5697 Approved
0.686 Remote Similarity NPD4756 Discovery
0.6848 Remote Similarity NPD3573 Approved
0.6837 Remote Similarity NPD5696 Approved
0.6832 Remote Similarity NPD5141 Approved
0.6824 Remote Similarity NPD8264 Approved
0.6818 Remote Similarity NPD4820 Approved
0.6818 Remote Similarity NPD4252 Approved
0.6818 Remote Similarity NPD4819 Approved
0.6818 Remote Similarity NPD4821 Approved
0.6818 Remote Similarity NPD4822 Approved
0.6813 Remote Similarity NPD7520 Clinical (unspecified phase)
0.6813 Remote Similarity NPD5329 Approved
0.6809 Remote Similarity NPD6698 Approved
0.6809 Remote Similarity NPD46 Approved
0.6804 Remote Similarity NPD7614 Phase 1
0.6804 Remote Similarity NPD4697 Phase 3
0.6796 Remote Similarity NPD6011 Approved
0.6796 Remote Similarity NPD6899 Approved
0.6796 Remote Similarity NPD6881 Approved
0.6796 Remote Similarity NPD6686 Approved
0.6782 Remote Similarity NPD3617 Approved
0.6782 Remote Similarity NPD4268 Approved
0.6782 Remote Similarity NPD4271 Approved
0.6778 Remote Similarity NPD5332 Approved
0.6778 Remote Similarity NPD5331 Approved
0.6771 Remote Similarity NPD7901 Clinical (unspecified phase)
0.6771 Remote Similarity NPD7900 Approved
0.6768 Remote Similarity NPD5286 Approved
0.6768 Remote Similarity NPD4696 Approved
0.6768 Remote Similarity NPD5285 Approved
0.6765 Remote Similarity NPD6402 Approved
0.6765 Remote Similarity NPD7128 Approved
0.6765 Remote Similarity NPD5739 Approved
0.6765 Remote Similarity NPD6675 Approved
0.6759 Remote Similarity NPD7115 Discovery
0.675 Remote Similarity NPD7341 Phase 2
0.6742 Remote Similarity NPD4790 Discontinued
0.6739 Remote Similarity NPD4693 Phase 3
0.6739 Remote Similarity NPD4689 Approved
0.6739 Remote Similarity NPD4688 Approved
0.6739 Remote Similarity NPD4138 Approved
0.6739 Remote Similarity NPD5786 Approved
0.6739 Remote Similarity NPD5205 Approved
0.6739 Remote Similarity NPD4690 Approved
0.6739 Remote Similarity NPD3574 Clinical (unspecified phase)
0.6735 Remote Similarity NPD4755 Approved
0.6731 Remote Similarity NPD6012 Approved
0.6731 Remote Similarity NPD6014 Approved
0.6731 Remote Similarity NPD6013 Approved
0.6703 Remote Similarity NPD3668 Phase 3
0.6701 Remote Similarity NPD1698 Clinical (unspecified phase)
0.67 Remote Similarity NPD5223 Approved
0.6699 Remote Similarity NPD5701 Approved
0.6698 Remote Similarity NPD6053 Discontinued
0.6667 Remote Similarity NPD7290 Approved
0.6667 Remote Similarity NPD7102 Approved
0.6667 Remote Similarity NPD6883 Approved
0.6635 Remote Similarity NPD7320 Approved
0.6634 Remote Similarity NPD4633 Approved
0.6634 Remote Similarity NPD5224 Approved
0.6634 Remote Similarity NPD5226 Approved
0.6634 Remote Similarity NPD5225 Approved
0.6632 Remote Similarity NPD5207 Approved
0.6632 Remote Similarity NPD5692 Phase 3
0.6629 Remote Similarity NPD5790 Clinical (unspecified phase)
0.6629 Remote Similarity NPD5368 Approved
0.6629 Remote Similarity NPD8259 Clinical (unspecified phase)
0.6628 Remote Similarity NPD8039 Approved
0.6604 Remote Similarity NPD6847 Approved
0.6604 Remote Similarity NPD8130 Phase 1
0.6604 Remote Similarity NPD6650 Approved
0.6604 Remote Similarity NPD6617 Approved
0.6604 Remote Similarity NPD6869 Approved
0.6604 Remote Similarity NPD6649 Approved
0.66 Remote Similarity NPD4700 Approved
0.6596 Remote Similarity NPD5208 Approved
0.6593 Remote Similarity NPD4788 Approved
0.6571 Remote Similarity NPD6373 Approved
0.6571 Remote Similarity NPD6372 Approved
0.6569 Remote Similarity NPD5174 Approved
0.6569 Remote Similarity NPD5175 Approved
0.6562 Remote Similarity NPD5693 Phase 1
0.6562 Remote Similarity NPD5694 Approved
0.6562 Remote Similarity NPD6050 Approved
0.6556 Remote Similarity NPD5369 Approved
0.6552 Remote Similarity NPD3701 Clinical (unspecified phase)
0.6548 Remote Similarity NPD4691 Approved
0.6542 Remote Similarity NPD6882 Approved
0.6542 Remote Similarity NPD8297 Approved
0.6526 Remote Similarity NPD6673 Approved
0.6526 Remote Similarity NPD6904 Approved
0.6526 Remote Similarity NPD6080 Approved
0.6522 Remote Similarity NPD6400 Clinical (unspecified phase)
0.6517 Remote Similarity NPD4195 Approved
0.6484 Remote Similarity NPD6435 Approved
0.6481 Remote Similarity NPD4632 Approved
0.6471 Remote Similarity NPD7632 Discontinued
0.6465 Remote Similarity NPD7732 Phase 3
0.6458 Remote Similarity NPD4096 Approved
0.6456 Remote Similarity NPD4246 Clinical (unspecified phase)
0.6449 Remote Similarity NPD6401 Clinical (unspecified phase)
0.6437 Remote Similarity NPD6942 Approved
0.6437 Remote Similarity NPD7339 Approved
0.6429 Remote Similarity NPD4137 Phase 3
0.6421 Remote Similarity NPD4518 Approved
0.642 Remote Similarity NPD3197 Phase 1
0.6415 Remote Similarity NPD4061 Clinical (unspecified phase)
0.6408 Remote Similarity NPD4754 Approved
0.6392 Remote Similarity NPD7637 Suspended
0.6392 Remote Similarity NPD7983 Approved
0.6383 Remote Similarity NPD6098 Approved
0.6381 Remote Similarity NPD6412 Phase 2
0.6375 Remote Similarity NPD4191 Approved
0.6375 Remote Similarity NPD4192 Approved
0.6375 Remote Similarity NPD4193 Approved
0.6375 Remote Similarity NPD4194 Approved
0.6374 Remote Similarity NPD4692 Approved
0.6374 Remote Similarity NPD4139 Approved
0.6364 Remote Similarity NPD6356 Clinical (unspecified phase)
0.6364 Remote Similarity NPD6868 Approved
0.6364 Remote Similarity NPD6274 Approved
0.6353 Remote Similarity NPD4747 Approved
0.6341 Remote Similarity NPD2685 Clinical (unspecified phase)
0.6337 Remote Similarity NPD8029 Clinical (unspecified phase)
0.6333 Remote Similarity NPD7645 Phase 2
0.6327 Remote Similarity NPD5133 Approved
0.6322 Remote Similarity NPD4687 Approved
0.6322 Remote Similarity NPD5733 Approved
0.6322 Remote Similarity NPD4058 Approved

Structure

External Identifiers

PubChem CID   45380214
ChEMBL   CHEMBL1088469
ZINC  

Physicochemical Properties

Molecular Weight:  250.16
ALogP:  0.9521
MLogP:  2.78
XLogP:  2.834
# Rotatable Bonds:  7
Polar Surface Area:  57.53
# H-Bond Aceptor:  3
# H-Bond Donor:  2
# Rings:  2
# Heavy Atoms:  18

Download Data

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Biological Activities  
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