Natural Product: NPC262324

Natural Product ID:  NPC262324
Common Name:   Dichapetalin L
IUPAC Name:  
Synonyms:   Dichapetalin L
Molecular Formula:   C38H50O5
Standard InCHIKey:  CXFAPKZJDHSDJC-NNLSLSRSSA-N
Standard InCHI:  InChI=1S/C38H50O5/c1-23(20-39)16-26-18-27(33(41)43-26)28-11-15-38-21-37(28,38)14-12-30-34(2)13-10-25-17-29(24-8-6-5-7-9-24)42-22-35(25,3)31(34)19-32(40)36(30,38)4/h5-10,16,26-32,39-40H,11-15,17-22H2,1-4H3/b23-16+/t26-,27-,28-,29-,30+,31+,32+,34+,35-,36-,37+,38+/m0/s1
Canonical SMILES:  OC/C(=C/[C@@H]1OC(=O)[C@@H](C1)[C@@H]1CC[C@@]23[C@]1(CC[C@H]1[C@@]3(C)[C@H](O)C[C@@H]3[C@]1(C)CC=C1[C@]3(C)CO[C@@H](C1)c1ccccc1)C2)/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
NPO9878 Dichapetalum gelonioides Species Dichapetalaceae Eukaryota Stem barks Philippines PMID[16562829]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT858 Cell Line LNCaP Homo sapiens ED50 = 1.1 ug/ml 14518939
NPT2345 Cell Line SW626 Homo sapiens ED50 = 8.3 ug/ml 22694318
NPT1034 Cell Line Lu1 Homo sapiens ED50 = 1 ug/ml PubChem BioAssay data set
NPT737 Cell Line HUVEC Homo sapiens ED50 = 4.2 ug/ml 21078949
NPT83 Cell Line MCF7 Homo sapiens ED50 = 2.1 ug/ml 21078949

  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 NPC262324 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
0.9847 High Similarity NPC79921
0.9846 High Similarity NPC243893
0.9692 High Similarity NPC471864
0.9021 High Similarity NPC261659
0.9014 High Similarity NPC253591
0.8944 High Similarity NPC475417
0.8944 High Similarity NPC475561
0.875 High Similarity NPC203486
0.8667 High Similarity NPC470278
0.8613 High Similarity NPC48929
0.8511 High Similarity NPC471862
0.8429 Intermediate Similarity NPC475373
0.8394 Intermediate Similarity NPC72915
0.8378 Intermediate Similarity NPC472658
0.8378 Intermediate Similarity NPC472657
0.8377 Intermediate Similarity NPC471861
0.837 Intermediate Similarity NPC253681
0.837 Intermediate Similarity NPC5486
0.8322 Intermediate Similarity NPC471856
0.8296 Intermediate Similarity NPC470816
0.8284 Intermediate Similarity NPC307139
0.8243 Intermediate Similarity NPC279442
0.8235 Intermediate Similarity NPC169913
0.8227 Intermediate Similarity NPC472374
0.8227 Intermediate Similarity NPC472372
0.8214 Intermediate Similarity NPC329913
0.8214 Intermediate Similarity NPC126516
0.8209 Intermediate Similarity NPC182333
0.8209 Intermediate Similarity NPC273336
0.8188 Intermediate Similarity NPC472548
0.8188 Intermediate Similarity NPC475138
0.8182 Intermediate Similarity NPC234548
0.8182 Intermediate Similarity NPC248287
0.8162 Intermediate Similarity NPC275576
0.8156 Intermediate Similarity NPC477893
0.8148 Intermediate Similarity NPC77691
0.8129 Intermediate Similarity NPC471858
0.8125 Intermediate Similarity NPC224491
0.8102 Intermediate Similarity NPC473220
0.8102 Intermediate Similarity NPC470753
0.8095 Intermediate Similarity NPC473602
0.8082 Intermediate Similarity NPC475122
0.8079 Intermediate Similarity NPC472549
0.8077 Intermediate Similarity NPC471850
0.8067 Intermediate Similarity NPC477905
0.8058 Intermediate Similarity NPC147561
0.8058 Intermediate Similarity NPC472388
0.8056 Intermediate Similarity NPC275592
0.8056 Intermediate Similarity NPC473440
0.8056 Intermediate Similarity NPC90614
0.8056 Intermediate Similarity NPC100913
0.8042 Intermediate Similarity NPC249817
0.8042 Intermediate Similarity NPC39549
0.8039 Intermediate Similarity NPC476784
0.8029 Intermediate Similarity NPC470765
0.8028 Intermediate Similarity NPC477896
0.8027 Intermediate Similarity NPC96903
0.8027 Intermediate Similarity NPC174982
0.8027 Intermediate Similarity NPC472568
0.8027 Intermediate Similarity NPC158663
0.8027 Intermediate Similarity NPC171525
0.8027 Intermediate Similarity NPC470157
0.8027 Intermediate Similarity NPC184817
0.8027 Intermediate Similarity NPC200471
0.8027 Intermediate Similarity NPC470159
0.8027 Intermediate Similarity NPC473088
0.8027 Intermediate Similarity NPC472556
0.8027 Intermediate Similarity NPC469349
0.8027 Intermediate Similarity NPC472571
0.8027 Intermediate Similarity NPC476973
0.8027 Intermediate Similarity NPC471104
0.8027 Intermediate Similarity NPC177940
0.8027 Intermediate Similarity NPC29704
0.8027 Intermediate Similarity NPC70403
0.8027 Intermediate Similarity NPC472572
0.8027 Intermediate Similarity NPC472575
0.8014 Intermediate Similarity NPC131966
0.8014 Intermediate Similarity NPC472656
0.8014 Intermediate Similarity NPC163087
0.8014 Intermediate Similarity NPC91703
0.8014 Intermediate Similarity NPC191387
0.8014 Intermediate Similarity NPC477894
0.8 Intermediate Similarity NPC27377
0.8 Intermediate Similarity NPC41481
0.8 Intermediate Similarity NPC291599
0.8 Intermediate Similarity NPC293831
0.8 Intermediate Similarity NPC472576
0.8 Intermediate Similarity NPC16912
0.8 Intermediate Similarity NPC87448
0.8 Intermediate Similarity NPC118080
0.8 Intermediate Similarity NPC369
0.8 Intermediate Similarity NPC97947
0.7987 Intermediate Similarity NPC266265
0.7987 Intermediate Similarity NPC471101
0.7987 Intermediate Similarity NPC270590
0.7987 Intermediate Similarity NPC471859
0.7987 Intermediate Similarity NPC471860
0.7987 Intermediate Similarity NPC92293
0.7987 Intermediate Similarity NPC301556
0.7986 Intermediate Similarity NPC198621
0.7986 Intermediate Similarity NPC216940
0.7986 Intermediate Similarity NPC225103
0.7986 Intermediate Similarity NPC475482
0.7986 Intermediate Similarity NPC22676
0.7985 Intermediate Similarity NPC183339
0.7985 Intermediate Similarity NPC133389
0.7985 Intermediate Similarity NPC234337
0.7973 Intermediate Similarity NPC474935
0.7972 Intermediate Similarity NPC472551
0.7972 Intermediate Similarity NPC173569
0.7972 Intermediate Similarity NPC472545
0.7972 Intermediate Similarity NPC477874
0.7971 Intermediate Similarity NPC171007
0.7971 Intermediate Similarity NPC190849
0.7959 Intermediate Similarity NPC472570
0.7959 Intermediate Similarity NPC188865
0.7959 Intermediate Similarity NPC57628
0.7959 Intermediate Similarity NPC25768
0.7959 Intermediate Similarity NPC11685
0.7959 Intermediate Similarity NPC95810
0.7959 Intermediate Similarity NPC472573
0.7959 Intermediate Similarity NPC475759
0.7959 Intermediate Similarity NPC70716
0.7959 Intermediate Similarity NPC241951
0.7959 Intermediate Similarity NPC95265
0.7959 Intermediate Similarity NPC163719
0.7959 Intermediate Similarity NPC125106
0.7959 Intermediate Similarity NPC470152
0.7959 Intermediate Similarity NPC472569
0.7959 Intermediate Similarity NPC476974
0.7945 Intermediate Similarity NPC140021
0.7945 Intermediate Similarity NPC172311
0.7945 Intermediate Similarity NPC475135
0.7933 Intermediate Similarity NPC325032
0.7933 Intermediate Similarity NPC125033
0.7933 Intermediate Similarity NPC477483
0.7931 Intermediate Similarity NPC183270
0.7931 Intermediate Similarity NPC472547
0.7931 Intermediate Similarity NPC477904
0.7931 Intermediate Similarity NPC97667
0.7931 Intermediate Similarity NPC475400
0.7931 Intermediate Similarity NPC171207
0.7929 Intermediate Similarity NPC473443
0.7929 Intermediate Similarity NPC49272
0.7919 Intermediate Similarity NPC132652
0.7919 Intermediate Similarity NPC281717
0.7905 Intermediate Similarity NPC477207
0.7902 Intermediate Similarity NPC473216
0.7902 Intermediate Similarity NPC11266
0.7902 Intermediate Similarity NPC473399
0.7895 Intermediate Similarity NPC45794
0.7891 Intermediate Similarity NPC477468
0.7881 Intermediate Similarity NPC470153
0.7871 Intermediate Similarity NPC309991
0.7871 Intermediate Similarity NPC326328
0.7871 Intermediate Similarity NPC323356
0.7871 Intermediate Similarity NPC471138
0.7867 Intermediate Similarity NPC476975
0.7867 Intermediate Similarity NPC473215
0.7862 Intermediate Similarity NPC210591
0.7862 Intermediate Similarity NPC214550
0.7862 Intermediate Similarity NPC472395
0.7862 Intermediate Similarity NPC475652
0.7862 Intermediate Similarity NPC472371
0.7857 Intermediate Similarity NPC318447
0.7857 Intermediate Similarity NPC322048
0.7853 Intermediate Similarity NPC475244
0.7852 Intermediate Similarity NPC478263
0.7852 Intermediate Similarity NPC240115
0.7848 Intermediate Similarity NPC477491
0.7847 Intermediate Similarity NPC472804
0.7843 Intermediate Similarity NPC473611
0.7843 Intermediate Similarity NPC132599
0.7843 Intermediate Similarity NPC469730
0.7843 Intermediate Similarity NPC473632
0.7838 Intermediate Similarity NPC470273
0.7832 Intermediate Similarity NPC310662
0.7832 Intermediate Similarity NPC471911
0.7832 Intermediate Similarity NPC474608
0.7832 Intermediate Similarity NPC4242
0.7829 Intermediate Similarity NPC233581
0.7829 Intermediate Similarity NPC469647
0.7829 Intermediate Similarity NPC22571
0.7829 Intermediate Similarity NPC138641
0.7829 Intermediate Similarity NPC283875
0.7829 Intermediate Similarity NPC469648
0.7829 Intermediate Similarity NPC145649
0.7823 Intermediate Similarity NPC472546
0.7823 Intermediate Similarity NPC472801
0.7823 Intermediate Similarity NPC27518
0.7823 Intermediate Similarity NPC63737
0.7823 Intermediate Similarity NPC192658
0.7823 Intermediate Similarity NPC183540
0.7823 Intermediate Similarity NPC34012
0.7823 Intermediate Similarity NPC304110
0.782 Intermediate Similarity NPC470820
0.7817 Intermediate Similarity NPC475493
0.7817 Intermediate Similarity NPC471880
0.7817 Intermediate Similarity NPC80599
0.7817 Intermediate Similarity NPC472394

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC262324 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
0.797 Intermediate Similarity NPD7741 Discontinued
0.7905 Intermediate Similarity NPD7236 Approved
0.7692 Intermediate Similarity NPD6663 Approved
0.7647 Intermediate Similarity NPD7239 Suspended
0.7546 Intermediate Similarity NPD7799 Discontinued
0.7535 Intermediate Similarity NPD5736 Approved
0.7451 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7431 Intermediate Similarity NPD5952 Clinical (unspecified phase)
0.7417 Intermediate Similarity NPD8166 Discontinued
0.7407 Intermediate Similarity NPD2629 Approved
0.7388 Intermediate Similarity NPD6858 Approved
0.7388 Intermediate Similarity NPD7094 Approved
0.7346 Intermediate Similarity NPD8127 Discontinued
0.7343 Intermediate Similarity NPD6007 Clinical (unspecified phase)
0.7226 Intermediate Similarity NPD4198 Discontinued
0.7222 Intermediate Similarity NPD6085 Phase 2
0.7222 Intermediate Similarity NPD5740 Clinical (unspecified phase)
0.7219 Intermediate Similarity NPD6003 Clinical (unspecified phase)
0.7219 Intermediate Similarity NPD6006 Clinical (unspecified phase)
0.7219 Intermediate Similarity NPD6002 Phase 3
0.7219 Intermediate Similarity NPD6004 Phase 3
0.7219 Intermediate Similarity NPD6005 Phase 3
0.7211 Intermediate Similarity NPD8032 Phase 2
0.7211 Intermediate Similarity NPD7961 Discontinued
0.7205 Intermediate Similarity NPD7057 Phase 3
0.7205 Intermediate Similarity NPD7058 Phase 2
0.72 Intermediate Similarity NPD7305 Phase 1
0.7192 Intermediate Similarity NPD7008 Discontinued
0.7179 Intermediate Similarity NPD6273 Approved
0.7163 Intermediate Similarity NPD7457 Clinical (unspecified phase)
0.7162 Intermediate Similarity NPD4140 Approved
0.7126 Intermediate Similarity NPD7228 Approved
0.7099 Intermediate Similarity NPD4967 Phase 2
0.7099 Intermediate Similarity NPD4965 Approved
0.7099 Intermediate Similarity NPD4966 Approved
0.7095 Intermediate Similarity NPD7714 Approved
0.7095 Intermediate Similarity NPD7715 Approved
0.7092 Intermediate Similarity NPD5126 Approved
0.7092 Intermediate Similarity NPD2932 Approved
0.7092 Intermediate Similarity NPD3019 Approved
0.7092 Intermediate Similarity NPD5125 Phase 3
0.7044 Intermediate Similarity NPD6591 Clinical (unspecified phase)
0.7027 Intermediate Similarity NPD3764 Approved
0.7019 Intermediate Similarity NPD37 Approved
0.6993 Remote Similarity NPD5762 Approved
0.6993 Remote Similarity NPD5763 Approved
0.6985 Remote Similarity NPD2181 Clinical (unspecified phase)
0.6975 Remote Similarity NPD5760 Phase 2
0.6975 Remote Similarity NPD5761 Phase 2
0.6972 Remote Similarity NPD3412 Clinical (unspecified phase)
0.6968 Remote Similarity NPD6398 Clinical (unspecified phase)
0.6957 Remote Similarity NPD6010 Discontinued
0.694 Remote Similarity NPD6685 Approved
0.6909 Remote Similarity NPD6234 Discontinued
0.6906 Remote Similarity NPD5951 Approved
0.6897 Remote Similarity NPD8055 Clinical (unspecified phase)
0.6887 Remote Similarity NPD6355 Discontinued
0.6887 Remote Similarity NPD5735 Approved
0.6883 Remote Similarity NPD7702 Clinical (unspecified phase)
0.6882 Remote Similarity NPD8470 Clinical (unspecified phase)
0.686 Remote Similarity NPD7240 Approved
0.6859 Remote Similarity NPD7003 Approved
0.6859 Remote Similarity NPD4628 Phase 3
0.6857 Remote Similarity NPD8424 Clinical (unspecified phase)
0.6853 Remote Similarity NPD7163 Clinical (unspecified phase)
0.6838 Remote Similarity NPD6831 Clinical (unspecified phase)
0.6835 Remote Similarity NPD4869 Clinical (unspecified phase)
0.6831 Remote Similarity NPD3091 Approved
0.6826 Remote Similarity NPD7199 Phase 2
0.6821 Remote Similarity NPD7966 Clinical (unspecified phase)
0.6806 Remote Similarity NPD3026 Approved
0.6806 Remote Similarity NPD3023 Approved
0.6797 Remote Similarity NPD7097 Phase 1
0.679 Remote Similarity NPD7028 Phase 2
0.6783 Remote Similarity NPD3025 Approved
0.6783 Remote Similarity NPD3024 Approved
0.6768 Remote Similarity NPD8455 Phase 2
0.6761 Remote Similarity NPD7610 Discontinued
0.6761 Remote Similarity NPD8434 Phase 2
0.6759 Remote Similarity NPD3092 Approved
0.6753 Remote Similarity NPD7033 Discontinued
0.6752 Remote Similarity NPD4110 Phase 3
0.6752 Remote Similarity NPD4109 Clinical (unspecified phase)
0.6748 Remote Similarity NPD7615 Clinical (unspecified phase)
0.6743 Remote Similarity NPD8407 Phase 2
0.6742 Remote Similarity NPD7639 Approved
0.6742 Remote Similarity NPD7640 Approved
0.6741 Remote Similarity NPD5048 Discontinued
0.6736 Remote Similarity NPD3095 Discontinued
0.6732 Remote Similarity NPD6353 Approved
0.6728 Remote Similarity NPD5808 Clinical (unspecified phase)
0.6728 Remote Similarity NPD7458 Discontinued
0.6716 Remote Similarity NPD5765 Approved
0.6716 Remote Similarity NPD5738 Clinical (unspecified phase)
0.6716 Remote Similarity NPD6647 Phase 2
0.671 Remote Similarity NPD6099 Approved
0.671 Remote Similarity NPD6100 Approved
0.671 Remote Similarity NPD7137 Phase 2
0.6709 Remote Similarity NPD7910 Clinical (unspecified phase)
0.6689 Remote Similarity NPD3094 Phase 2
0.6685 Remote Similarity NPD8360 Approved
0.6685 Remote Similarity NPD8361 Approved
0.6667 Remote Similarity NPD7055 Discontinued
0.6667 Remote Similarity NPD5909 Discontinued
0.6667 Remote Similarity NPD8368 Discontinued
0.6667 Remote Similarity NPD5327 Phase 3
0.6667 Remote Similarity NPD6764 Approved
0.6667 Remote Similarity NPD8150 Discontinued
0.6667 Remote Similarity NPD7638 Approved
0.6667 Remote Similarity NPD6765 Approved
0.6647 Remote Similarity NPD7184 Clinical (unspecified phase)
0.6625 Remote Similarity NPD6143 Clinical (unspecified phase)
0.6622 Remote Similarity NPD1283 Approved
0.662 Remote Similarity NPD7115 Discovery
0.66 Remote Similarity NPD2861 Phase 2
0.6599 Remote Similarity NPD1608 Approved
0.6594 Remote Similarity NPD2182 Approved
0.6592 Remote Similarity NPD8435 Approved
0.6591 Remote Similarity NPD8312 Approved
0.6591 Remote Similarity NPD8313 Approved
0.6588 Remote Similarity NPD7229 Phase 3
0.6582 Remote Similarity NPD7421 Clinical (unspecified phase)
0.6579 Remote Similarity NPD6410 Clinical (unspecified phase)
0.6579 Remote Similarity NPD6859 Clinical (unspecified phase)
0.6579 Remote Similarity NPD6798 Discontinued
0.6571 Remote Similarity NPD6912 Phase 3
0.6571 Remote Similarity NPD7685 Pre-registration
0.6566 Remote Similarity NPD7819 Suspended
0.6557 Remote Similarity NPD8485 Approved
0.6552 Remote Similarity NPD5585 Approved
0.6549 Remote Similarity NPD4766 Approved
0.6533 Remote Similarity NPD6917 Clinical (unspecified phase)
0.6533 Remote Similarity NPD5647 Approved
0.6533 Remote Similarity NPD4624 Approved
0.6527 Remote Similarity NPD8443 Clinical (unspecified phase)
0.6517 Remote Similarity NPD6784 Approved
0.6517 Remote Similarity NPD6785 Approved
0.6516 Remote Similarity NPD6653 Approved
0.6513 Remote Similarity NPD7095 Approved
0.6507 Remote Similarity NPD1778 Approved
0.6494 Remote Similarity NPD5844 Phase 1
0.6494 Remote Similarity NPD2979 Phase 3
0.6494 Remote Similarity NPD3620 Phase 2
0.6494 Remote Similarity NPD3619 Clinical (unspecified phase)
0.6493 Remote Similarity NPD7798 Approved
0.6488 Remote Similarity NPD7768 Phase 2
0.6481 Remote Similarity NPD2533 Approved
0.6481 Remote Similarity NPD8389 Clinical (unspecified phase)
0.6481 Remote Similarity NPD2532 Approved
0.6481 Remote Similarity NPD2534 Approved
0.6471 Remote Similarity NPD4907 Clinical (unspecified phase)
0.6471 Remote Similarity NPD1699 Clinical (unspecified phase)
0.6467 Remote Similarity NPD2797 Approved
0.6458 Remote Similarity NPD4230 Clinical (unspecified phase)
0.6456 Remote Similarity NPD2346 Discontinued
0.6453 Remote Similarity NPD8051 Clinical (unspecified phase)
0.6452 Remote Similarity NPD5124 Phase 1
0.6452 Remote Similarity NPD8486 Clinical (unspecified phase)
0.6452 Remote Similarity NPD5123 Clinical (unspecified phase)
0.6447 Remote Similarity NPD4908 Phase 1
0.6441 Remote Similarity NPD8658 Clinical (unspecified phase)
0.6439 Remote Similarity NPD1693 Approved
0.6438 Remote Similarity NPD3750 Approved
0.6436 Remote Similarity NPD7497 Discontinued
0.6436 Remote Similarity NPD7680 Approved
0.6429 Remote Similarity NPD7879 Clinical (unspecified phase)
0.6429 Remote Similarity NPD7713 Phase 3
0.6429 Remote Similarity NPD2067 Discontinued
0.6424 Remote Similarity NPD3226 Approved
0.6419 Remote Similarity NPD6287 Discontinued
0.6419 Remote Similarity NPD4806 Approved
0.6419 Remote Similarity NPD1281 Approved
0.6419 Remote Similarity NPD4807 Approved
0.6418 Remote Similarity NPD9495 Approved
0.6416 Remote Similarity NPD7997 Clinical (unspecified phase)
0.6412 Remote Similarity NPD1088 Approved
0.6412 Remote Similarity NPD5537 Clinical (unspecified phase)
0.6409 Remote Similarity NPD8397 Clinical (unspecified phase)
0.64 Remote Similarity NPD8651 Approved
0.6398 Remote Similarity NPD7237 Clinical (unspecified phase)
0.6398 Remote Similarity NPD6190 Approved
0.6398 Remote Similarity NPD7274 Clinical (unspecified phase)
0.6395 Remote Similarity NPD17 Approved
0.6395 Remote Similarity NPD5305 Approved
0.6395 Remote Similarity NPD5306 Approved
0.6395 Remote Similarity NPD7315 Approved
0.6395 Remote Similarity NPD7725 Approved
0.6395 Remote Similarity NPD4059 Approved
0.6392 Remote Similarity NPD5406 Approved
0.6392 Remote Similarity NPD2438 Suspended
0.6392 Remote Similarity NPD5404 Approved
0.6392 Remote Similarity NPD5405 Approved
0.6392 Remote Similarity NPD5408 Approved
0.6391 Remote Similarity NPD1989 Approved
0.6387 Remote Similarity NPD4060 Phase 1
0.6382 Remote Similarity NPD3664 Approved
0.6382 Remote Similarity NPD3661 Approved
0.6382 Remote Similarity NPD3662 Phase 3
0.6382 Remote Similarity NPD3663 Approved
0.637 Remote Similarity NPD9545 Approved

Structure

External Identifiers

PubChem CID   11685706
ChEMBL   CHEMBL445723
ZINC  

Physicochemical Properties

Molecular Weight:  586.37
ALogP:  1.5158
MLogP:  5.09
XLogP:  8.041
# Rotatable Bonds:  10
Polar Surface Area:  75.99
# H-Bond Aceptor:  5
# H-Bond Donor:  2
# Rings:  8
# Heavy Atoms:  43

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Biological Activities  
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