Natural Product: NPC108342

Natural Product ID:  NPC108342
Common Name:   n.a.
IUPAC Name:  
Synonyms:   10-Methoxyliriodenine
Molecular Formula:   C18H11NO4
Standard InCHIKey:  BHFUORVSBHCRKK-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C18H11NO4/c1-21-10-2-3-11-12(7-10)15-14-9(4-5-19-16(14)17(11)20)6-13-18(15)23-8-22-13/h2-7H,8H2,1H3
Canonical SMILES:  COc1ccc2c(c1)c1c3OCOc3cc3c1c(C2=O)ncc3
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
NPO16455 Xylopia aethiopica Species Annonaceae Eukaryota PMID[8158166]
NPO33359 miliusa cf. banacea Species Annonaceae Eukaryota PMID[8158166]
NPO2239 Mahonia manipurensis NA NA NA UNPD*
NPO16209 Garcinia brasiliensis Species Clusiaceae Eukaryota UNPD*
NPO3947 Corydalis sheareri Species Papaveraceae Eukaryota UNPD*
NPO4942 Scenedesmus acutus Species Scenedesmaceae Eukaryota UNPD*
NPO1683 Abies magnifica Species Pinaceae Eukaryota UNPD*
NPO7140 Millettia taiwaniana Species Fabaceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT312 Organism Saccharomyces cerevisiae Saccharomyces cerevisiae Activity = 113 ug/ml 8158166
NPT312 Organism Saccharomyces cerevisiae Saccharomyces cerevisiae Activity = 214 ug/ml 8158166
NPT1044 Individual Protein DNA topoisomerase II alpha Homo sapiens IC50 = 25 ug/ml 8158166

  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 NPC108342 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
0.9952 High Similarity NPC189903
0.9952 High Similarity NPC182907
0.981 High Similarity NPC166722
0.9809 High Similarity NPC22481
0.976 High Similarity NPC278525
0.9718 High Similarity NPC210296
0.9674 High Similarity NPC124313
0.9673 High Similarity NPC84164
0.9673 High Similarity NPC207283
0.9571 High Similarity NPC24019
0.9471 High Similarity NPC210434
0.9455 High Similarity NPC183537
0.939 High Similarity NPC233334
0.9367 High Similarity NPC77878
0.9302 High Similarity NPC90875
0.9095 High Similarity NPC15406
0.8995 High Similarity NPC236668
0.8952 High Similarity NPC146976
0.8768 High Similarity NPC251160
0.861 High Similarity NPC253675
0.8585 High Similarity NPC470020
0.8502 High Similarity NPC119134
0.8442 Intermediate Similarity NPC270515
0.8426 Intermediate Similarity NPC235076
0.8411 Intermediate Similarity NPC188420
0.8333 Intermediate Similarity NPC477019
0.8311 Intermediate Similarity NPC23614
0.8311 Intermediate Similarity NPC100079
0.8295 Intermediate Similarity NPC271215
0.8295 Intermediate Similarity NPC149471
0.8288 Intermediate Similarity NPC322482
0.8273 Intermediate Similarity NPC46451
0.8249 Intermediate Similarity NPC53069
0.8249 Intermediate Similarity NPC202768
0.8249 Intermediate Similarity NPC296482
0.8246 Intermediate Similarity NPC234197
0.8186 Intermediate Similarity NPC478045
0.8186 Intermediate Similarity NPC313189
0.8165 Intermediate Similarity NPC96405
0.8165 Intermediate Similarity NPC171409
0.8161 Intermediate Similarity NPC118121
0.8161 Intermediate Similarity NPC122463
0.8145 Intermediate Similarity NPC204446
0.8133 Intermediate Similarity NPC470018
0.8102 Intermediate Similarity NPC135549
0.8097 Intermediate Similarity NPC74575
0.8086 Intermediate Similarity NPC195268
0.8086 Intermediate Similarity NPC133140
0.8025 Intermediate Similarity NPC132385
0.8 Intermediate Similarity NPC216612
0.7983 Intermediate Similarity NPC137353
0.7957 Intermediate Similarity NPC49547
0.7931 Intermediate Similarity NPC470017
0.7928 Intermediate Similarity NPC55470
0.7926 Intermediate Similarity NPC476581
0.7926 Intermediate Similarity NPC36229
0.7926 Intermediate Similarity NPC16452
0.7897 Intermediate Similarity NPC470022
0.786 Intermediate Similarity NPC476582
0.786 Intermediate Similarity NPC4071
0.786 Intermediate Similarity NPC476578
0.7832 Intermediate Similarity NPC174049
0.7826 Intermediate Similarity NPC246381
0.7788 Intermediate Similarity NPC31930
0.7773 Intermediate Similarity NPC193238
0.7753 Intermediate Similarity NPC54066
0.7718 Intermediate Similarity NPC134637
0.7705 Intermediate Similarity NPC318068
0.7699 Intermediate Similarity NPC208522
0.7689 Intermediate Similarity NPC72905
0.7679 Intermediate Similarity NPC202605
0.7679 Intermediate Similarity NPC112206
0.7668 Intermediate Similarity NPC290689
0.7665 Intermediate Similarity NPC473822
0.7657 Intermediate Similarity NPC142385
0.765 Intermediate Similarity NPC471004
0.765 Intermediate Similarity NPC23080
0.765 Intermediate Similarity NPC193906
0.7642 Intermediate Similarity NPC129897
0.7634 Intermediate Similarity NPC220337
0.7613 Intermediate Similarity NPC308943
0.7605 Intermediate Similarity NPC41501
0.7593 Intermediate Similarity NPC107123
0.754 Intermediate Similarity NPC191489
0.7534 Intermediate Similarity NPC5374
0.75 Intermediate Similarity NPC94842
0.7488 Intermediate Similarity NPC312531
0.7488 Intermediate Similarity NPC206201
0.7469 Intermediate Similarity NPC302807
0.7468 Intermediate Similarity NPC255800
0.7468 Intermediate Similarity NPC96584
0.7458 Intermediate Similarity NPC201508
0.7457 Intermediate Similarity NPC477788
0.7455 Intermediate Similarity NPC222561
0.7449 Intermediate Similarity NPC303374
0.743 Intermediate Similarity NPC204385
0.7427 Intermediate Similarity NPC148889
0.7425 Intermediate Similarity NPC122436
0.7421 Intermediate Similarity NPC315634
0.7421 Intermediate Similarity NPC100734
0.7421 Intermediate Similarity NPC88923
0.7419 Intermediate Similarity NPC13603
0.7409 Intermediate Similarity NPC71124
0.7385 Intermediate Similarity NPC254957
0.7383 Intermediate Similarity NPC249405
0.7379 Intermediate Similarity NPC326930
0.7379 Intermediate Similarity NPC85879
0.7379 Intermediate Similarity NPC475301
0.7379 Intermediate Similarity NPC53255
0.7375 Intermediate Similarity NPC235685
0.7364 Intermediate Similarity NPC224928
0.7362 Intermediate Similarity NPC473506
0.7352 Intermediate Similarity NPC146724
0.7347 Intermediate Similarity NPC1608
0.7344 Intermediate Similarity NPC101350
0.7341 Intermediate Similarity NPC328928
0.7339 Intermediate Similarity NPC280799
0.7336 Intermediate Similarity NPC232225
0.7331 Intermediate Similarity NPC122968
0.7331 Intermediate Similarity NPC473833
0.7331 Intermediate Similarity NPC477787
0.7331 Intermediate Similarity NPC328186
0.7331 Intermediate Similarity NPC475631
0.7331 Intermediate Similarity NPC476110
0.7331 Intermediate Similarity NPC87152
0.7331 Intermediate Similarity NPC228377
0.7331 Intermediate Similarity NPC89549
0.7331 Intermediate Similarity NPC475600
0.733 Intermediate Similarity NPC127085
0.7325 Intermediate Similarity NPC208284
0.7321 Intermediate Similarity NPC207971
0.7314 Intermediate Similarity NPC253482
0.7311 Intermediate Similarity NPC316841
0.7311 Intermediate Similarity NPC475303
0.7311 Intermediate Similarity NPC292416
0.7311 Intermediate Similarity NPC475596
0.7311 Intermediate Similarity NPC473689
0.7304 Intermediate Similarity NPC4421
0.7303 Intermediate Similarity NPC472061
0.73 Intermediate Similarity NPC475644
0.73 Intermediate Similarity NPC470486
0.73 Intermediate Similarity NPC471977
0.73 Intermediate Similarity NPC471190
0.7296 Intermediate Similarity NPC469439
0.7295 Intermediate Similarity NPC475648
0.7292 Intermediate Similarity NPC475406
0.7289 Intermediate Similarity NPC268077
0.7284 Intermediate Similarity NPC473115
0.7284 Intermediate Similarity NPC158020
0.7284 Intermediate Similarity NPC6576
0.7284 Intermediate Similarity NPC212768
0.7284 Intermediate Similarity NPC217554
0.7284 Intermediate Similarity NPC473089
0.7284 Intermediate Similarity NPC75600
0.7281 Intermediate Similarity NPC474009
0.728 Intermediate Similarity NPC244839
0.728 Intermediate Similarity NPC319880
0.728 Intermediate Similarity NPC320324
0.728 Intermediate Similarity NPC30456
0.7265 Intermediate Similarity NPC284141
0.7261 Intermediate Similarity NPC327904
0.7261 Intermediate Similarity NPC38959
0.7257 Intermediate Similarity NPC300156
0.7256 Intermediate Similarity NPC179704
0.7255 Intermediate Similarity NPC470042
0.725 Intermediate Similarity NPC237702
0.725 Intermediate Similarity NPC329631
0.7243 Intermediate Similarity NPC168922
0.7238 Intermediate Similarity NPC260434
0.7238 Intermediate Similarity NPC476999
0.7238 Intermediate Similarity NPC474688
0.7229 Intermediate Similarity NPC298449
0.7222 Intermediate Similarity NPC284685
0.722 Intermediate Similarity NPC327769
0.7216 Intermediate Similarity NPC9482
0.7213 Intermediate Similarity NPC475844
0.7212 Intermediate Similarity NPC38961
0.7206 Intermediate Similarity NPC324619
0.7206 Intermediate Similarity NPC475315
0.7203 Intermediate Similarity NPC76565
0.7203 Intermediate Similarity NPC250807
0.7203 Intermediate Similarity NPC57797
0.7202 Intermediate Similarity NPC11408
0.7196 Intermediate Similarity NPC287588
0.7193 Intermediate Similarity NPC100573
0.7193 Intermediate Similarity NPC82548
0.7193 Intermediate Similarity NPC207873
0.7191 Intermediate Similarity NPC477903
0.7186 Intermediate Similarity NPC162530
0.7186 Intermediate Similarity NPC324361
0.7186 Intermediate Similarity NPC266931
0.7185 Intermediate Similarity NPC146824
0.7185 Intermediate Similarity NPC478078
0.7181 Intermediate Similarity NPC45190
0.7179 Intermediate Similarity NPC301368
0.7179 Intermediate Similarity NPC84815
0.7179 Intermediate Similarity NPC74360
0.7173 Intermediate Similarity NPC475498
0.7173 Intermediate Similarity NPC473850
0.7173 Intermediate Similarity NPC328154

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC108342 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
0.8273 Intermediate Similarity NPD3763 Approved
0.8249 Intermediate Similarity NPD3815 Phase 1
0.8249 Intermediate Similarity NPD3816 Phase 1
0.8086 Intermediate Similarity NPD3922 Approved
0.8086 Intermediate Similarity NPD3923 Approved
0.8086 Intermediate Similarity NPD3924 Approved
0.8086 Intermediate Similarity NPD3921 Approved
0.7992 Intermediate Similarity NPD4926 Clinical (unspecified phase)
0.7679 Intermediate Similarity NPD7885 Phase 2
0.7679 Intermediate Similarity NPD7886 Phase 2
0.7673 Intermediate Similarity NPD8091 Phase 3
0.7647 Intermediate Similarity NPD6790 Phase 1
0.7644 Intermediate Similarity NPD7571 Clinical (unspecified phase)
0.76 Intermediate Similarity NPD7069 Discontinued
0.7574 Intermediate Similarity NPD4885 Approved
0.7564 Intermediate Similarity NPD5801 Clinical (unspecified phase)
0.756 Intermediate Similarity NPD3920 Phase 2
0.754 Intermediate Similarity NPD7708 Approved
0.7531 Intermediate Similarity NPD8350 Clinical (unspecified phase)
0.7521 Intermediate Similarity NPD5805 Approved
0.75 Intermediate Similarity NPD6525 Clinical (unspecified phase)
0.7469 Intermediate Similarity NPD1483 Discontinued
0.7468 Intermediate Similarity NPD6494 Phase 2
0.7446 Intermediate Similarity NPD6242 Discontinued
0.7421 Intermediate Similarity NPD7803 Approved
0.7371 Intermediate Similarity NPD7862 Clinical (unspecified phase)
0.7368 Intermediate Similarity NPD5866 Approved
0.7359 Intermediate Similarity NPD7395 Discontinued
0.7359 Intermediate Similarity NPD6568 Discontinued
0.7358 Intermediate Similarity NPD5482 Discontinued
0.7315 Intermediate Similarity NPD6257 Clinical (unspecified phase)
0.7292 Intermediate Similarity NPD6964 Approved
0.7292 Intermediate Similarity NPD6963 Approved
0.7273 Intermediate Similarity NPD6727 Phase 2
0.7265 Intermediate Similarity NPD5483 Clinical (unspecified phase)
0.725 Intermediate Similarity NPD5040 Clinical (unspecified phase)
0.725 Intermediate Similarity NPD6741 Clinical (unspecified phase)
0.7241 Intermediate Similarity NPD4989 Phase 2
0.7236 Intermediate Similarity NPD5488 Discontinued
0.7222 Intermediate Similarity NPD7955 Approved
0.7222 Intermediate Similarity NPD4889 Approved
0.7222 Intermediate Similarity NPD7956 Approved
0.7213 Intermediate Similarity NPD7417 Discontinued
0.721 Intermediate Similarity NPD4429 Discontinued
0.72 Intermediate Similarity NPD6477 Clinical (unspecified phase)
0.7184 Intermediate Similarity NPD6716 Phase 1
0.7172 Intermediate Similarity NPD2921 Clinical (unspecified phase)
0.7167 Intermediate Similarity NPD3326 Clinical (unspecified phase)
0.7166 Intermediate Similarity NPD6460 Clinical (unspecified phase)
0.7163 Intermediate Similarity NPD7414 Clinical (unspecified phase)
0.7149 Intermediate Similarity NPD5429 Discontinued
0.7126 Intermediate Similarity NPD6531 Approved
0.7126 Intermediate Similarity NPD6530 Approved
0.7125 Intermediate Similarity NPD4952 Phase 3
0.7125 Intermediate Similarity NPD8052 Clinical (unspecified phase)
0.7101 Intermediate Similarity NPD6247 Clinical (unspecified phase)
0.71 Intermediate Similarity NPD7927 Clinical (unspecified phase)
0.7099 Intermediate Similarity NPD3217 Phase 2
0.7076 Intermediate Similarity NPD8479 Phase 2
0.7064 Intermediate Similarity NPD3354 Phase 2
0.7059 Intermediate Similarity NPD6228 Discontinued
0.7054 Intermediate Similarity NPD5022 Discontinued
0.7049 Intermediate Similarity NPD3006 Discontinued
0.7047 Intermediate Similarity NPD7169 Suspended
0.7045 Intermediate Similarity NPD6517 Phase 3
0.7043 Intermediate Similarity NPD5658 Approved
0.7042 Intermediate Similarity NPD3259 Approved
0.704 Intermediate Similarity NPD4418 Discontinued
0.7037 Intermediate Similarity NPD4373 Phase 2
0.7018 Intermediate Similarity NPD5513 Phase 2
0.7017 Intermediate Similarity NPD2285 Clinical (unspecified phase)
0.7016 Intermediate Similarity NPD5450 Discontinued
0.7012 Intermediate Similarity NPD7588 Discontinued
0.7009 Intermediate Similarity NPD1923 Clinical (unspecified phase)
0.7005 Intermediate Similarity NPD3386 Phase 2
0.7 Intermediate Similarity NPD3263 Phase 3
0.7 Intermediate Similarity NPD7426 Phase 1
0.6988 Remote Similarity NPD6230 Discontinued
0.6987 Remote Similarity NPD7278 Phase 2
0.6987 Remote Similarity NPD7279 Phase 2
0.6987 Remote Similarity NPD3946 Clinical (unspecified phase)
0.6983 Remote Similarity NPD5914 Approved
0.6983 Remote Similarity NPD4997 Clinical (unspecified phase)
0.6973 Remote Similarity NPD5459 Phase 2
0.697 Remote Similarity NPD4859 Phase 1
0.6962 Remote Similarity NPD5519 Discontinued
0.696 Remote Similarity NPD6219 Discontinued
0.696 Remote Similarity NPD8468 Phase 2
0.6957 Remote Similarity NPD7010 Phase 3
0.6955 Remote Similarity NPD6962 Phase 2
0.6936 Remote Similarity NPD3257 Approved
0.692 Remote Similarity NPD5632 Approved
0.6911 Remote Similarity NPD5891 Approved
0.6907 Remote Similarity NPD8149 Discontinued
0.6905 Remote Similarity NPD4558 Phase 2
0.6904 Remote Similarity NPD4923 Phase 1
0.6901 Remote Similarity NPD7268 Clinical (unspecified phase)
0.6901 Remote Similarity NPD7994 Phase 2
0.6898 Remote Similarity NPD7558 Phase 2
0.6897 Remote Similarity NPD7467 Discontinued
0.6895 Remote Similarity NPD8016 Phase 3
0.6895 Remote Similarity NPD8017 Clinical (unspecified phase)
0.689 Remote Similarity NPD7859 Phase 2
0.6883 Remote Similarity NPD5530 Phase 1
0.6878 Remote Similarity NPD4375 Approved
0.6875 Remote Similarity NPD6569 Phase 2
0.6875 Remote Similarity NPD6160 Clinical (unspecified phase)
0.6872 Remote Similarity NPD7710 Clinical (unspecified phase)
0.6862 Remote Similarity NPD5850 Phase 3
0.6862 Remote Similarity NPD5930 Phase 3
0.6861 Remote Similarity NPD6281 Approved
0.686 Remote Similarity NPD5640 Discontinued
0.6858 Remote Similarity NPD7673 Phase 3
0.6853 Remote Similarity NPD7222 Phase 2
0.6851 Remote Similarity NPD7225 Discontinued
0.685 Remote Similarity NPD6503 Clinical (unspecified phase)
0.684 Remote Similarity NPD4037 Approved
0.684 Remote Similarity NPD4038 Approved
0.684 Remote Similarity NPD31 Approved
0.684 Remote Similarity NPD4039 Approved
0.684 Remote Similarity NPD4036 Approved
0.684 Remote Similarity NPD4035 Approved
0.684 Remote Similarity NPD4033 Approved
0.684 Remote Similarity NPD4034 Approved
0.684 Remote Similarity NPD32 Approved
0.684 Remote Similarity NPD4122 Approved
0.6837 Remote Similarity NPD1078 Clinical (unspecified phase)
0.6835 Remote Similarity NPD1620 Clinical (unspecified phase)
0.683 Remote Similarity NPD2334 Discontinued
0.6825 Remote Similarity NPD8100 Phase 3
0.682 Remote Similarity NPD3258 Approved
0.682 Remote Similarity NPD6974 Phase 3
0.6816 Remote Similarity NPD1505 Phase 2
0.6814 Remote Similarity NPD5975 Clinical (unspecified phase)
0.6812 Remote Similarity NPD4396 Clinical (unspecified phase)
0.681 Remote Similarity NPD5601 Phase 2
0.6803 Remote Similarity NPD7555 Discontinued
0.6796 Remote Similarity NPD8279 Clinical (unspecified phase)
0.6795 Remote Similarity NPD5867 Clinical (unspecified phase)
0.6793 Remote Similarity NPD7538 Clinical (unspecified phase)
0.6792 Remote Similarity NPD7180 Phase 3
0.6787 Remote Similarity NPD6825 Phase 1
0.6787 Remote Similarity NPD6745 Discontinued
0.6784 Remote Similarity NPD6550 Discontinued
0.6784 Remote Similarity NPD5512 Phase 3
0.6776 Remote Similarity NPD7567 Approved
0.6773 Remote Similarity NPD4875 Phase 3
0.6773 Remote Similarity NPD4876 Phase 3
0.677 Remote Similarity NPD1038 Approved
0.677 Remote Similarity NPD4551 Phase 2
0.677 Remote Similarity NPD1304 Clinical (unspecified phase)
0.6768 Remote Similarity NPD7924 Phase 2
0.6768 Remote Similarity NPD7925 Phase 2
0.6765 Remote Similarity NPD5612 Discontinued
0.6765 Remote Similarity NPD2433 Clinical (unspecified phase)
0.6762 Remote Similarity NPD4845 Discontinued
0.6762 Remote Similarity NPD4328 Approved
0.6762 Remote Similarity NPD6553 Clinical (unspecified phase)
0.6753 Remote Similarity NPD6975 Discontinued
0.6745 Remote Similarity NPD8101 Phase 3
0.6744 Remote Similarity NPD6872 Clinical (unspecified phase)
0.6741 Remote Similarity NPD7233 Approved
0.6741 Remote Similarity NPD7234 Approved
0.6738 Remote Similarity NPD2060 Approved
0.6737 Remote Similarity NPD7703 Clinical (unspecified phase)
0.6737 Remote Similarity NPD6567 Clinical (unspecified phase)
0.6736 Remote Similarity NPD6824 Clinical (unspecified phase)
0.6734 Remote Similarity NPD7807 Clinical (unspecified phase)
0.6732 Remote Similarity NPD8463 Approved
0.6732 Remote Similarity NPD3328 Phase 2
0.6732 Remote Similarity NPD8358 Approved
0.6732 Remote Similarity NPD5532 Phase 2
0.6732 Remote Similarity NPD6276 Discontinued
0.6729 Remote Similarity NPD2782 Approved
0.6729 Remote Similarity NPD2780 Approved
0.6723 Remote Similarity NPD4667 Clinical (unspecified phase)
0.6722 Remote Similarity NPD5070 Clinical (unspecified phase)
0.672 Remote Similarity NPD7729 Clinical (unspecified phase)
0.6708 Remote Similarity NPD7547 Clinical (unspecified phase)
0.6707 Remote Similarity NPD5479 Discontinued
0.6707 Remote Similarity NPD7853 Phase 2
0.6706 Remote Similarity NPD8102 Discontinued
0.6703 Remote Similarity NPD7690 Clinical (unspecified phase)
0.6696 Remote Similarity NPD6361 Phase 2
0.6696 Remote Similarity NPD4118 Clinical (unspecified phase)
0.6695 Remote Similarity NPD3393 Approved
0.6695 Remote Similarity NPD4795 Phase 2
0.6695 Remote Similarity NPD6138 Clinical (unspecified phase)
0.6695 Remote Similarity NPD3947 Discontinued
0.6695 Remote Similarity NPD3394 Approved
0.6695 Remote Similarity NPD6987 Phase 1
0.6695 Remote Similarity NPD3389 Approved
0.6694 Remote Similarity NPD6298 Discontinued
0.6692 Remote Similarity NPD7689 Approved
0.6681 Remote Similarity NPD2739 Clinical (unspecified phase)
0.6681 Remote Similarity NPD3945 Discontinued
0.668 Remote Similarity NPD4958 Clinical (unspecified phase)
0.668 Remote Similarity NPD3925 Approved
0.668 Remote Similarity NPD4846 Phase 2
0.6667 Remote Similarity NPD4502 Phase 2

Structure

External Identifiers

PubChem CID   73104
ChEMBL   CHEMBL471281
ZINC  

Physicochemical Properties

Molecular Weight:  305.07
ALogP:  -0.6183
MLogP:  2.89
XLogP:  2.198
# Rotatable Bonds:  2
Polar Surface Area:  57.65
# H-Bond Aceptor:  2
# H-Bond Donor:  0
# Rings:  5
# Heavy Atoms:  23

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