Natural Product: NPC469977

Natural Product ID:  NPC469977
Common Name:   Sid47200685
IUPAC Name:   (E)-3-(1,3-benzodioxol-5-yl)-N-cyclopentylprop-2-enamide
Synonyms:  
Molecular Formula:   C15H17NO3
Standard InCHIKey:  SLFOTQIGIXJPPD-SOFGYWHQSA-N
Standard InCHI:  InChI=1S/C15H17NO3/c17-15(16-12-3-1-2-4-12)8-6-11-5-7-13-14(9-11)19-10-18-13/h5-9,12H,1-4,10H2,(H,16,17)/b8-6+
Canonical SMILES:  OC(=NC1CCCC1)/C=C/c1ccc2c(c1)OCO2
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
NPO28928 Piper nigrum Species Piperaceae Eukaryota PMID[23102654]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT582 Individual Protein Monoamine oxidase B Homo sapiens IC50 = 1130 nM 23819826
NPT64 Individual Protein ATPase family AAA domain-containing protein 5 Homo sapiens Potency 12589.3 nM 20462757
NPT261 Individual Protein Monoamine oxidase A Homo sapiens IC50 > 100000 nM 22738629
NPT152 Individual Protein Nuclear factor erythroid 2-related factor 2 Homo sapiens Potency 29092.9 nM 10.6019/CHEMBL1201861
NPT2 Others Unspecified Potency 7943.3 nM 19075048
NPT11 Individual Protein Guanine nucleotide-binding protein G(s), subunit alpha Homo sapiens Potency 11220.2 nM 15027854
NPT157 Individual Protein Breast cancer type 1 susceptibility protein Homo sapiens Potency 35481.3 nM 20579892
NPT484 Individual Protein Luciferin 4-monooxygenase Photinus pyralis Potency 15101.4 nM 24328283
NPT531 Individual Protein Nuclear receptor ROR-gamma Mus musculus Potency = 14125.4 nM 10346950
NPT54 Individual Protein Nonstructural protein 1 Influenza A virus Potency = 3981.1 nM 23002924
NPT6 Organism Plasmodium falciparum Plasmodium falciparum Potency 2078.7 nM 17311456
NPT1043 Individual Protein Glycoprotein hormones alpha chain Homo sapiens Potency 22387.2 nM 25856683
NPT2 Others Unspecified Potency = 3264.3 nM 19604701

  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 NPC469977 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
0.9597 High Similarity NPC470706
0.9355 High Similarity NPC251466
0.935 High Similarity NPC300955
0.9274 High Similarity NPC170583
0.9274 High Similarity NPC246133
0.9274 High Similarity NPC71105
0.9274 High Similarity NPC152186
0.9274 High Similarity NPC207541
0.9274 High Similarity NPC182147
0.92 High Similarity NPC156944
0.9127 High Similarity NPC157740
0.9127 High Similarity NPC291449
0.9127 High Similarity NPC99798
0.9127 High Similarity NPC41331
0.9055 High Similarity NPC147247
0.9055 High Similarity NPC246974
0.8855 High Similarity NPC473463
0.8828 High Similarity NPC191302
0.8712 High Similarity NPC284855
0.8712 High Similarity NPC282477
0.8519 High Similarity NPC254610
0.8462 Intermediate Similarity NPC301713
0.8397 Intermediate Similarity NPC153990
0.8333 Intermediate Similarity NPC275150
0.8333 Intermediate Similarity NPC155838
0.8271 Intermediate Similarity NPC195749
0.8271 Intermediate Similarity NPC35961
0.8271 Intermediate Similarity NPC52029
0.8261 Intermediate Similarity NPC77572
0.8258 Intermediate Similarity NPC186898
0.8197 Intermediate Similarity NPC127326
0.8148 Intermediate Similarity NPC214869
0.813 Intermediate Similarity NPC31279
0.812 Intermediate Similarity NPC251571
0.8099 Intermediate Similarity NPC327623
0.8074 Intermediate Similarity NPC114102
0.8074 Intermediate Similarity NPC308885
0.8074 Intermediate Similarity NPC255550
0.8015 Intermediate Similarity NPC318862
0.8015 Intermediate Similarity NPC130595
0.8015 Intermediate Similarity NPC93882
0.7984 Intermediate Similarity NPC57501
0.7956 Intermediate Similarity NPC6854
0.7956 Intermediate Similarity NPC313737
0.7956 Intermediate Similarity NPC285078
0.792 Intermediate Similarity NPC166837
0.7899 Intermediate Similarity NPC193673
0.7899 Intermediate Similarity NPC94280
0.7899 Intermediate Similarity NPC218530
0.7899 Intermediate Similarity NPC167096
0.7899 Intermediate Similarity NPC103947
0.7899 Intermediate Similarity NPC45783
0.7899 Intermediate Similarity NPC159150
0.7899 Intermediate Similarity NPC328419
0.7883 Intermediate Similarity NPC217574
0.7857 Intermediate Similarity NPC194359
0.7857 Intermediate Similarity NPC41473
0.7857 Intermediate Similarity NPC204848
0.7857 Intermediate Similarity NPC312770
0.7857 Intermediate Similarity NPC28641
0.7857 Intermediate Similarity NPC160607
0.7857 Intermediate Similarity NPC14600
0.7842 Intermediate Similarity NPC230698
0.7842 Intermediate Similarity NPC96406
0.7842 Intermediate Similarity NPC196609
0.7842 Intermediate Similarity NPC255817
0.7842 Intermediate Similarity NPC251454
0.7842 Intermediate Similarity NPC73883
0.7842 Intermediate Similarity NPC277042
0.7842 Intermediate Similarity NPC180647
0.7842 Intermediate Similarity NPC205178
0.7842 Intermediate Similarity NPC136330
0.782 Intermediate Similarity NPC249788
0.7801 Intermediate Similarity NPC296898
0.7801 Intermediate Similarity NPC299583
0.7786 Intermediate Similarity NPC145446
0.7786 Intermediate Similarity NPC99078
0.7786 Intermediate Similarity NPC137172
0.777 Intermediate Similarity NPC474560
0.7752 Intermediate Similarity NPC111225
0.7742 Intermediate Similarity NPC227894
0.773 Intermediate Similarity NPC220923
0.773 Intermediate Similarity NPC470707
0.773 Intermediate Similarity NPC248505
0.773 Intermediate Similarity NPC193528
0.773 Intermediate Similarity NPC95366
0.773 Intermediate Similarity NPC252107
0.773 Intermediate Similarity NPC225745
0.7727 Intermediate Similarity NPC183262
0.771 Intermediate Similarity NPC69670
0.7692 Intermediate Similarity NPC199209
0.7692 Intermediate Similarity NPC212643
0.7692 Intermediate Similarity NPC33271
0.7692 Intermediate Similarity NPC120075
0.7687 Intermediate Similarity NPC140359
0.7687 Intermediate Similarity NPC13020
0.7677 Intermediate Similarity NPC198741
0.7674 Intermediate Similarity NPC303370
0.7669 Intermediate Similarity NPC80241
0.7669 Intermediate Similarity NPC301641
0.766 Intermediate Similarity NPC416184
0.7652 Intermediate Similarity NPC263835
0.7652 Intermediate Similarity NPC344161
0.7647 Intermediate Similarity NPC40352
0.7647 Intermediate Similarity NPC213711
0.7647 Intermediate Similarity NPC274356
0.7638 Intermediate Similarity NPC55300
0.7626 Intermediate Similarity NPC118419
0.7623 Intermediate Similarity NPC12714
0.7623 Intermediate Similarity NPC310905
0.7622 Intermediate Similarity NPC477837
0.7622 Intermediate Similarity NPC477838
0.7619 Intermediate Similarity NPC36108
0.7619 Intermediate Similarity NPC233731
0.7619 Intermediate Similarity NPC246358
0.7619 Intermediate Similarity NPC7097
0.7612 Intermediate Similarity NPC298486
0.7582 Intermediate Similarity NPC69360
0.7578 Intermediate Similarity NPC165646
0.7576 Intermediate Similarity NPC43275
0.7576 Intermediate Similarity NPC119949
0.7559 Intermediate Similarity NPC137685
0.7557 Intermediate Similarity NPC283468
0.7537 Intermediate Similarity NPC211992
0.7537 Intermediate Similarity NPC114845
0.7535 Intermediate Similarity NPC7018
0.7519 Intermediate Similarity NPC471308
0.7519 Intermediate Similarity NPC289330
0.7519 Intermediate Similarity NPC160120
0.7519 Intermediate Similarity NPC17388
0.7519 Intermediate Similarity NPC53596
0.7517 Intermediate Similarity NPC222039
0.7517 Intermediate Similarity NPC100478
0.75 Intermediate Similarity NPC156840
0.75 Intermediate Similarity NPC257124
0.75 Intermediate Similarity NPC8547
0.75 Intermediate Similarity NPC78918
0.75 Intermediate Similarity NPC292792
0.75 Intermediate Similarity NPC122009
0.75 Intermediate Similarity NPC173746
0.75 Intermediate Similarity NPC139617
0.7483 Intermediate Similarity NPC5462
0.7482 Intermediate Similarity NPC470633
0.7482 Intermediate Similarity NPC228769
0.7481 Intermediate Similarity NPC256167
0.7465 Intermediate Similarity NPC11147
0.7463 Intermediate Similarity NPC83279
0.7462 Intermediate Similarity NPC142599
0.7462 Intermediate Similarity NPC294941
0.746 Intermediate Similarity NPC258171
0.745 Intermediate Similarity NPC475959
0.7447 Intermediate Similarity NPC259742
0.7447 Intermediate Similarity NPC147616
0.7447 Intermediate Similarity NPC219671
0.7447 Intermediate Similarity NPC104077
0.7444 Intermediate Similarity NPC256369
0.7436 Intermediate Similarity NPC189782
0.7429 Intermediate Similarity NPC184814
0.7429 Intermediate Similarity NPC171550
0.7429 Intermediate Similarity NPC134764
0.7429 Intermediate Similarity NPC63574
0.7429 Intermediate Similarity NPC476570
0.7429 Intermediate Similarity NPC275950
0.7426 Intermediate Similarity NPC211218
0.7419 Intermediate Similarity NPC97072
0.7419 Intermediate Similarity NPC215829
0.7413 Intermediate Similarity NPC469808
0.7407 Intermediate Similarity NPC193484
0.7402 Intermediate Similarity NPC146530
0.74 Intermediate Similarity NPC182119
0.7397 Intermediate Similarity NPC475698
0.7394 Intermediate Similarity NPC169973
0.7391 Intermediate Similarity NPC473960
0.7389 Intermediate Similarity NPC89199
0.7389 Intermediate Similarity NPC54125
0.7376 Intermediate Similarity NPC476345
0.7372 Intermediate Similarity NPC95733
0.7372 Intermediate Similarity NPC62101
0.7368 Intermediate Similarity NPC270811
0.7368 Intermediate Similarity NPC471073
0.7365 Intermediate Similarity NPC469978
0.7365 Intermediate Similarity NPC145304
0.7353 Intermediate Similarity NPC471315
0.7353 Intermediate Similarity NPC471314
0.7348 Intermediate Similarity NPC258992
0.7347 Intermediate Similarity NPC178466
0.7347 Intermediate Similarity NPC63628
0.7343 Intermediate Similarity NPC264956
0.7338 Intermediate Similarity NPC177167
0.7338 Intermediate Similarity NPC158737
0.7338 Intermediate Similarity NPC172403
0.7338 Intermediate Similarity NPC291847
0.7333 Intermediate Similarity NPC471032
0.7333 Intermediate Similarity NPC153644
0.7333 Intermediate Similarity NPC470935
0.7329 Intermediate Similarity NPC228040
0.7324 Intermediate Similarity NPC227002
0.7324 Intermediate Similarity NPC97316
0.7324 Intermediate Similarity NPC471505
0.7324 Intermediate Similarity NPC252833

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC469977 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
0.8148 Intermediate Similarity NPD554 Clinical (unspecified phase)
0.8125 Intermediate Similarity NPD1357 Approved
0.8074 Intermediate Similarity NPD3145 Approved
0.8074 Intermediate Similarity NPD3144 Approved
0.8015 Intermediate Similarity NPD2674 Phase 3
0.7929 Intermediate Similarity NPD2161 Phase 2
0.7862 Intermediate Similarity NPD4739 Approved
0.7842 Intermediate Similarity NPD2492 Phase 1
0.7754 Intermediate Similarity NPD1726 Clinical (unspecified phase)
0.7746 Intermediate Similarity NPD1375 Discontinued
0.7609 Intermediate Similarity NPD2669 Clinical (unspecified phase)
0.7586 Intermediate Similarity NPD6331 Phase 2
0.7566 Intermediate Similarity NPD5563 Clinical (unspecified phase)
0.7556 Intermediate Similarity NPD1669 Approved
0.7556 Intermediate Similarity NPD3676 Clinical (unspecified phase)
0.7534 Intermediate Similarity NPD5084 Clinical (unspecified phase)
0.7532 Intermediate Similarity NPD5604 Discontinued
0.75 Intermediate Similarity NPD2922 Phase 1
0.75 Intermediate Similarity NPD228 Approved
0.75 Intermediate Similarity NPD7945 Clinical (unspecified phase)
0.7465 Intermediate Similarity NPD2157 Approved
0.7451 Intermediate Similarity NPD2978 Approved
0.7451 Intermediate Similarity NPD2977 Approved
0.7448 Intermediate Similarity NPD7153 Discontinued
0.7407 Intermediate Similarity NPD3705 Approved
0.7407 Intermediate Similarity NPD776 Approved
0.74 Intermediate Similarity NPD2122 Discontinued
0.7397 Intermediate Similarity NPD4237 Approved
0.7397 Intermediate Similarity NPD4236 Phase 3
0.7365 Intermediate Similarity NPD6783 Clinical (unspecified phase)
0.7361 Intermediate Similarity NPD4108 Discontinued
0.7347 Intermediate Similarity NPD6658 Clinical (unspecified phase)
0.7338 Intermediate Similarity NPD5772 Approved
0.7338 Intermediate Similarity NPD1712 Approved
0.7338 Intermediate Similarity NPD5773 Approved
0.7333 Intermediate Similarity NPD7527 Clinical (unspecified phase)
0.7333 Intermediate Similarity NPD52 Approved
0.7333 Intermediate Similarity NPD7526 Approved
0.7286 Intermediate Similarity NPD5752 Clinical (unspecified phase)
0.7267 Intermediate Similarity NPD4123 Phase 3
0.7267 Intermediate Similarity NPD1771 Clinical (unspecified phase)
0.7234 Intermediate Similarity NPD1024 Discontinued
0.7222 Intermediate Similarity NPD1772 Clinical (unspecified phase)
0.7214 Intermediate Similarity NPD2040 Clinical (unspecified phase)
0.7197 Intermediate Similarity NPD7975 Clinical (unspecified phase)
0.7183 Intermediate Similarity NPD5111 Phase 2
0.7183 Intermediate Similarity NPD5718 Phase 2
0.7183 Intermediate Similarity NPD5109 Approved
0.7183 Intermediate Similarity NPD5110 Phase 2
0.7181 Intermediate Similarity NPD5241 Discontinued
0.7143 Intermediate Similarity NPD709 Approved
0.7143 Intermediate Similarity NPD7243 Clinical (unspecified phase)
0.7121 Intermediate Similarity NPD5283 Phase 1
0.7105 Intermediate Similarity NPD5261 Clinical (unspecified phase)
0.7095 Intermediate Similarity NPD1372 Clinical (unspecified phase)
0.7095 Intermediate Similarity NPD1044 Clinical (unspecified phase)
0.7086 Intermediate Similarity NPD4357 Discontinued
0.7078 Intermediate Similarity NPD4005 Discontinued
0.7067 Intermediate Similarity NPD2219 Phase 1
0.705 Intermediate Similarity NPD3685 Discontinued
0.7047 Intermediate Similarity NPD3060 Approved
0.7045 Intermediate Similarity NPD821 Approved
0.7032 Intermediate Similarity NPD4675 Approved
0.7032 Intermediate Similarity NPD4678 Approved
0.7014 Intermediate Similarity NPD840 Approved
0.7014 Intermediate Similarity NPD839 Approved
0.7007 Intermediate Similarity NPD2667 Approved
0.7007 Intermediate Similarity NPD2668 Approved
0.6987 Remote Similarity NPD5090 Approved
0.6987 Remote Similarity NPD5089 Approved
0.6986 Remote Similarity NPD2653 Approved
0.698 Remote Similarity NPD4664 Clinical (unspecified phase)
0.6978 Remote Similarity NPD2233 Approved
0.6978 Remote Similarity NPD2232 Approved
0.6978 Remote Similarity NPD2230 Approved
0.6978 Remote Similarity NPD2337 Clinical (unspecified phase)
0.6972 Remote Similarity NPD4993 Discontinued
0.6966 Remote Similarity NPD1558 Phase 1
0.6962 Remote Similarity NPD2358 Clinical (unspecified phase)
0.6939 Remote Similarity NPD6895 Approved
0.6939 Remote Similarity NPD6896 Approved
0.6933 Remote Similarity NPD4162 Approved
0.6929 Remote Similarity NPD4379 Clinical (unspecified phase)
0.6917 Remote Similarity NPD9377 Approved
0.6917 Remote Similarity NPD9379 Approved
0.6913 Remote Similarity NPD3656 Approved
0.6912 Remote Similarity NPD5536 Phase 2
0.6903 Remote Similarity NPD4210 Discontinued
0.6897 Remote Similarity NPD1423 Approved
0.6894 Remote Similarity NPD2644 Approved
0.6892 Remote Similarity NPD6029 Clinical (unspecified phase)
0.6892 Remote Similarity NPD6028 Clinical (unspecified phase)
0.6875 Remote Similarity NPD4055 Discovery
0.6863 Remote Similarity NPD6143 Clinical (unspecified phase)
0.6857 Remote Similarity NPD2231 Phase 2
0.6857 Remote Similarity NPD2235 Phase 2
0.6831 Remote Similarity NPD1819 Approved
0.6831 Remote Similarity NPD1820 Approved
0.6831 Remote Similarity NPD1817 Approved
0.6831 Remote Similarity NPD1818 Approved
0.6828 Remote Similarity NPD1039 Discontinued
0.6828 Remote Similarity NPD1048 Approved
0.6824 Remote Similarity NPD6111 Discontinued
0.6821 Remote Similarity NPD5177 Phase 3
0.6818 Remote Similarity NPD1754 Clinical (unspecified phase)
0.6815 Remote Similarity NPD593 Approved
0.6815 Remote Similarity NPD595 Approved
0.6809 Remote Similarity NPD1421 Approved
0.6809 Remote Similarity NPD1420 Approved
0.6806 Remote Similarity NPD596 Approved
0.6806 Remote Similarity NPD600 Approved
0.6802 Remote Similarity NPD3408 Clinical (unspecified phase)
0.6795 Remote Similarity NPD3686 Approved
0.6795 Remote Similarity NPD3687 Approved
0.679 Remote Similarity NPD7201 Clinical (unspecified phase)
0.6783 Remote Similarity NPD558 Phase 2
0.6783 Remote Similarity NPD6584 Phase 3
0.6781 Remote Similarity NPD7477 Discontinued
0.6768 Remote Similarity NPD4083 Discontinued
0.6761 Remote Similarity NPD196 Phase 1
0.6755 Remote Similarity NPD2808 Discontinued
0.6755 Remote Similarity NPD7596 Clinical (unspecified phase)
0.6755 Remote Similarity NPD4149 Clinical (unspecified phase)
0.6752 Remote Similarity NPD3111 Phase 1
0.6748 Remote Similarity NPD2821 Approved
0.6742 Remote Similarity NPD2684 Approved
0.6739 Remote Similarity NPD1182 Approved
0.6735 Remote Similarity NPD5837 Clinical (unspecified phase)
0.6733 Remote Similarity NPD3175 Clinical (unspecified phase)
0.6732 Remote Similarity NPD3692 Discontinued
0.6713 Remote Similarity NPD3053 Approved
0.6713 Remote Similarity NPD3055 Approved
0.671 Remote Similarity NPD4584 Approved
0.6707 Remote Similarity NPD4606 Clinical (unspecified phase)
0.6706 Remote Similarity NPD7281 Phase 3
0.6706 Remote Similarity NPD7280 Phase 3
0.6692 Remote Similarity NPD556 Approved
0.669 Remote Similarity NPD2983 Phase 2
0.669 Remote Similarity NPD9622 Approved
0.669 Remote Similarity NPD2982 Phase 2
0.6688 Remote Similarity NPD950 Clinical (unspecified phase)
0.6687 Remote Similarity NPD5602 Clinical (unspecified phase)
0.6687 Remote Similarity NPD6818 Clinical (unspecified phase)
0.6667 Remote Similarity NPD1350 Approved
0.6667 Remote Similarity NPD3647 Clinical (unspecified phase)
0.6667 Remote Similarity NPD6390 Discontinued
0.6667 Remote Similarity NPD4109 Clinical (unspecified phase)
0.6667 Remote Similarity NPD5745 Approved
0.6667 Remote Similarity NPD1351 Approved
0.6667 Remote Similarity NPD1349 Approved
0.6667 Remote Similarity NPD4110 Phase 3
0.6667 Remote Similarity NPD3693 Clinical (unspecified phase)
0.6667 Remote Similarity NPD1358 Approved
0.6646 Remote Similarity NPD2560 Approved
0.6646 Remote Similarity NPD824 Approved
0.6646 Remote Similarity NPD2563 Approved
0.6645 Remote Similarity NPD5297 Approved
0.6644 Remote Similarity NPD3027 Phase 3
0.6644 Remote Similarity NPD3164 Approved
0.6644 Remote Similarity NPD3167 Approved
0.6644 Remote Similarity NPD3179 Approved
0.6644 Remote Similarity NPD3180 Approved
0.6644 Remote Similarity NPD3166 Approved
0.6644 Remote Similarity NPD3165 Approved
0.6644 Remote Similarity NPD4579 Clinical (unspecified phase)
0.6643 Remote Similarity NPD9381 Approved
0.6643 Remote Similarity NPD9384 Approved
0.6642 Remote Similarity NPD9280 Clinical (unspecified phase)
0.6627 Remote Similarity NPD7007 Discovery
0.6623 Remote Similarity NPD5307 Clinical (unspecified phase)
0.6622 Remote Similarity NPD2238 Phase 2
0.6622 Remote Similarity NPD3620 Phase 2
0.6622 Remote Similarity NPD3619 Clinical (unspecified phase)
0.6621 Remote Similarity NPD2250 Discontinued
0.6621 Remote Similarity NPD9494 Approved
0.6621 Remote Similarity NPD2407 Clinical (unspecified phase)
0.662 Remote Similarity NPD2981 Phase 2
0.6606 Remote Similarity NPD7315 Approved
0.6604 Remote Similarity NPD7028 Phase 2
0.6604 Remote Similarity NPD1642 Discontinued
0.6603 Remote Similarity NPD2505 Approved
0.6603 Remote Similarity NPD2504 Approved
0.6599 Remote Similarity NPD597 Approved
0.6599 Remote Similarity NPD601 Approved
0.6599 Remote Similarity NPD598 Approved
0.6597 Remote Similarity NPD1770 Clinical (unspecified phase)
0.6597 Remote Similarity NPD1794 Approved
0.6591 Remote Similarity NPD1444 Approved
0.6591 Remote Similarity NPD1445 Approved
0.6587 Remote Similarity NPD9296 Approved
0.6582 Remote Similarity NPD2883 Discontinued
0.6581 Remote Similarity NPD7124 Phase 2
0.6573 Remote Similarity NPD6582 Phase 2
0.6573 Remote Similarity NPD6583 Phase 3
0.6571 Remote Similarity NPD1797 Approved
0.6571 Remote Similarity NPD1798 Approved
0.6566 Remote Similarity NPD2969 Approved
0.6566 Remote Similarity NPD2970 Approved
0.6565 Remote Similarity NPD9610 Approved
0.6565 Remote Similarity NPD9608 Approved

Structure

External Identifiers

PubChem CID   871734
ChEMBL   CHEMBL1575961
ZINC  

Physicochemical Properties

Molecular Weight:  259.12
ALogP:  -1.3377
MLogP:  2.67
XLogP:  3.21
# Rotatable Bonds:  4
Polar Surface Area:  51.05
# H-Bond Aceptor:  2
# H-Bond Donor:  1
# Rings:  3
# Heavy Atoms:  19

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Biological Activities  
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