Natural Product: NPC469314

Natural Product ID:  NPC469314
Common Name:   (8S,10S,11S,14R)-11-Hydroxy-4,4,8,10,14-Pentamethyl-17-[(2R,4S,5S)-4,5,6-Trihydroxy-6-Methylheptan-2-Yl]-1,2,5,6,7,9,11,12,15,16-Decahydrocyclopenta[A]Phenanthren-3-One
IUPAC Name:   (8S,10S,11S,14R)-11-hydroxy-4,4,8,10,14-pentamethyl-17-[(2R,4S,5S)-4,5,6-trihydroxy-6-methylheptan-2-yl]-1,2,5,6,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-3-one
Synonyms:  
Molecular Formula:   C30H50O5
Standard InCHIKey:  HNOSJVWYGXOFRP-CABDFSJESA-N
Standard InCHI:  InChI=1S/C30H50O5/c1-17(15-21(32)25(34)27(4,5)35)18-9-13-29(7)19(18)16-20(31)24-28(6)12-11-23(33)26(2,3)22(28)10-14-30(24,29)8/h17,20-22,24-25,31-32,34-35H,9-16H2,1-8H3/t17-,20+,21+,22?,24?,25+,28+,29+,30+/m1/s1
Canonical SMILES:  O[C@H]([C@@H](C(O)(C)C)O)C[C@H](C1=C2C[C@H](O)C3[C@]([C@]2(CC1)C)(C)CCC1[C@]3(C)CCC(=O)C1(C)C)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
NPO30648 Alisma orientale Species Alismataceae Eukaryota Rhizomes PMID[10560729]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT32 Organism Mus musculus Mus musculus Inhibition = 30 % Open TG-GATES in vivo data: Hematology
NPT32 Organism Mus musculus Mus musculus Inhibition = 21.4 % Open TG-GATES in vivo data: Hematology
NPT32 Organism Mus musculus Mus musculus Inhibition = 5.8 % 20850971
NPT32 Organism Mus musculus Mus musculus IC50 > 10000 nM 11087594
NPT32 Organism Mus musculus Mus musculus Inhibition = 112.7 % 11087594
NPT32 Organism Mus musculus Mus musculus Inhibition = 111.2 % 11087594

  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 NPC469314 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 NPC241875
1.0 High Similarity NPC469317
0.9529 High Similarity NPC473166
0.9506 High Similarity NPC86370
0.9419 High Similarity NPC274046
0.9419 High Similarity NPC198074
0.9302 High Similarity NPC473167
0.9294 High Similarity NPC469319
0.9294 High Similarity NPC229871
0.9205 High Similarity NPC37787
0.9205 High Similarity NPC180557
0.9205 High Similarity NPC30677
0.9205 High Similarity NPC469329
0.9205 High Similarity NPC473415
0.8989 High Similarity NPC473170
0.8901 High Similarity NPC471784
0.8901 High Similarity NPC303777
0.8889 High Similarity NPC471777
0.8876 High Similarity NPC240617
0.8851 High Similarity NPC77263
0.8851 High Similarity NPC250592
0.8851 High Similarity NPC32830
0.8837 High Similarity NPC138756
0.8837 High Similarity NPC469322
0.8721 High Similarity NPC471737
0.8706 High Similarity NPC473157
0.8652 High Similarity NPC155304
0.8621 High Similarity NPC90652
0.8617 High Similarity NPC469316
0.8605 High Similarity NPC197823
0.8539 High Similarity NPC136801
0.8526 High Similarity NPC324001
0.8523 High Similarity NPC474677
0.8523 High Similarity NPC470417
0.8523 High Similarity NPC193360
0.8511 High Similarity NPC469327
0.8511 High Similarity NPC476897
0.8444 Intermediate Similarity NPC235704
0.8427 Intermediate Similarity NPC1015
0.8427 Intermediate Similarity NPC31985
0.8427 Intermediate Similarity NPC474245
0.8427 Intermediate Similarity NPC122116
0.8404 Intermediate Similarity NPC473176
0.8387 Intermediate Similarity NPC474785
0.8387 Intermediate Similarity NPC474938
0.837 Intermediate Similarity NPC200702
0.8351 Intermediate Similarity NPC470587
0.8333 Intermediate Similarity NPC85173
0.8333 Intermediate Similarity NPC126993
0.8315 Intermediate Similarity NPC230387
0.8315 Intermediate Similarity NPC44181
0.8295 Intermediate Similarity NPC213412
0.8295 Intermediate Similarity NPC56588
0.828 Intermediate Similarity NPC471822
0.8276 Intermediate Similarity NPC59453
0.8276 Intermediate Similarity NPC221758
0.8265 Intermediate Similarity NPC469318
0.8265 Intermediate Similarity NPC473173
0.8265 Intermediate Similarity NPC473165
0.8265 Intermediate Similarity NPC471783
0.8265 Intermediate Similarity NPC9457
0.8261 Intermediate Similarity NPC473172
0.8256 Intermediate Similarity NPC212083
0.8256 Intermediate Similarity NPC151519
0.8242 Intermediate Similarity NPC86266
0.8242 Intermediate Similarity NPC110657
0.8242 Intermediate Similarity NPC189520
0.8242 Intermediate Similarity NPC212301
0.8222 Intermediate Similarity NPC119416
0.8222 Intermediate Similarity NPC474704
0.8222 Intermediate Similarity NPC475921
0.8202 Intermediate Similarity NPC475740
0.8202 Intermediate Similarity NPC99909
0.8202 Intermediate Similarity NPC73064
0.8191 Intermediate Similarity NPC170978
0.8191 Intermediate Similarity NPC9613
0.8191 Intermediate Similarity NPC247139
0.8182 Intermediate Similarity NPC470574
0.8182 Intermediate Similarity NPC133954
0.8172 Intermediate Similarity NPC32118
0.8163 Intermediate Similarity NPC472655
0.8161 Intermediate Similarity NPC472743
0.8161 Intermediate Similarity NPC475726
0.8152 Intermediate Similarity NPC474806
0.8152 Intermediate Similarity NPC170220
0.8152 Intermediate Similarity NPC107674
0.8152 Intermediate Similarity NPC141497
0.8152 Intermediate Similarity NPC275809
0.8152 Intermediate Similarity NPC133579
0.8152 Intermediate Similarity NPC12722
0.8144 Intermediate Similarity NPC191892
0.8144 Intermediate Similarity NPC471005
0.8132 Intermediate Similarity NPC46758
0.8132 Intermediate Similarity NPC126369
0.8132 Intermediate Similarity NPC49320
0.8132 Intermediate Similarity NPC111110
0.8132 Intermediate Similarity NPC470589
0.8118 Intermediate Similarity NPC476812
0.8111 Intermediate Similarity NPC292491
0.8111 Intermediate Similarity NPC310752
0.8111 Intermediate Similarity NPC53911
0.8111 Intermediate Similarity NPC242864
0.8111 Intermediate Similarity NPC471722
0.8105 Intermediate Similarity NPC191565
0.8095 Intermediate Similarity NPC472746
0.8095 Intermediate Similarity NPC149249
0.809 Intermediate Similarity NPC31564
0.809 Intermediate Similarity NPC474733
0.809 Intermediate Similarity NPC74363
0.809 Intermediate Similarity NPC89077
0.809 Intermediate Similarity NPC73038
0.809 Intermediate Similarity NPC158393
0.809 Intermediate Similarity NPC145879
0.809 Intermediate Similarity NPC51014
0.809 Intermediate Similarity NPC474732
0.809 Intermediate Similarity NPC474778
0.809 Intermediate Similarity NPC72133
0.809 Intermediate Similarity NPC475862
0.809 Intermediate Similarity NPC473168
0.8085 Intermediate Similarity NPC473158
0.8085 Intermediate Similarity NPC73004
0.8085 Intermediate Similarity NPC204961
0.8085 Intermediate Similarity NPC158371
0.8085 Intermediate Similarity NPC207922
0.8085 Intermediate Similarity NPC259733
0.8085 Intermediate Similarity NPC88847
0.8085 Intermediate Similarity NPC473164
0.8085 Intermediate Similarity NPC173744
0.8085 Intermediate Similarity NPC117133
0.8068 Intermediate Similarity NPC180834
0.8068 Intermediate Similarity NPC475745
0.8068 Intermediate Similarity NPC474482
0.8068 Intermediate Similarity NPC171789
0.8065 Intermediate Similarity NPC32407
0.8065 Intermediate Similarity NPC231063
0.8065 Intermediate Similarity NPC209662
0.8065 Intermediate Similarity NPC263548
0.8065 Intermediate Similarity NPC88116
0.8065 Intermediate Similarity NPC49670
0.8065 Intermediate Similarity NPC472977
0.8065 Intermediate Similarity NPC114159
0.8065 Intermediate Similarity NPC474690
0.8065 Intermediate Similarity NPC145667
0.8065 Intermediate Similarity NPC282395
0.8065 Intermediate Similarity NPC6818
0.8065 Intermediate Similarity NPC174051
0.8065 Intermediate Similarity NPC67831
0.8065 Intermediate Similarity NPC20235
0.8065 Intermediate Similarity NPC196485
0.8065 Intermediate Similarity NPC299996
0.8065 Intermediate Similarity NPC472976
0.8065 Intermediate Similarity NPC245972
0.8065 Intermediate Similarity NPC191412
0.8046 Intermediate Similarity NPC30166
0.8046 Intermediate Similarity NPC469325
0.8046 Intermediate Similarity NPC48362
0.8043 Intermediate Similarity NPC235884
0.8043 Intermediate Similarity NPC71074
0.8043 Intermediate Similarity NPC52021
0.8043 Intermediate Similarity NPC472149
0.8043 Intermediate Similarity NPC262870
0.8043 Intermediate Similarity NPC131872
0.8043 Intermediate Similarity NPC272746
0.8043 Intermediate Similarity NPC84319
0.8043 Intermediate Similarity NPC300351
0.8043 Intermediate Similarity NPC306541
0.8043 Intermediate Similarity NPC25299
0.8023 Intermediate Similarity NPC13554
0.8023 Intermediate Similarity NPC22403
0.8022 Intermediate Similarity NPC270768
0.8022 Intermediate Similarity NPC143232
0.8022 Intermediate Similarity NPC130520
0.8022 Intermediate Similarity NPC274330
0.8022 Intermediate Similarity NPC61543
0.8022 Intermediate Similarity NPC225585
0.8022 Intermediate Similarity NPC293048
0.8022 Intermediate Similarity NPC220498
0.8022 Intermediate Similarity NPC234346
0.8022 Intermediate Similarity NPC127689
0.8022 Intermediate Similarity NPC76879
0.8022 Intermediate Similarity NPC198664
0.8022 Intermediate Similarity NPC59263
0.8022 Intermediate Similarity NPC121798
0.8022 Intermediate Similarity NPC263393
0.8021 Intermediate Similarity NPC110149
0.8021 Intermediate Similarity NPC35239
0.8021 Intermediate Similarity NPC316964
0.802 Intermediate Similarity NPC470065
0.8 Intermediate Similarity NPC58063
0.8 Intermediate Similarity NPC259788
0.8 Intermediate Similarity NPC142361
0.8 Intermediate Similarity NPC272451
0.8 Intermediate Similarity NPC477926
0.8 Intermediate Similarity NPC141292
0.8 Intermediate Similarity NPC174619
0.8 Intermediate Similarity NPC474684
0.8 Intermediate Similarity NPC264005
0.8 Intermediate Similarity NPC255589
0.8 Intermediate Similarity NPC269360
0.8 Intermediate Similarity NPC190554

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC469314 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
0.8276 Intermediate Similarity NPD4786 Approved
0.8256 Intermediate Similarity NPD3667 Approved
0.809 Intermediate Similarity NPD3618 Phase 1
0.8022 Intermediate Similarity NPD5328 Approved
0.7849 Intermediate Similarity NPD6079 Approved
0.7849 Intermediate Similarity NPD7515 Phase 2
0.7816 Intermediate Similarity NPD7525 Registered
0.7812 Intermediate Similarity NPD4755 Approved
0.7778 Intermediate Similarity NPD7520 Clinical (unspecified phase)
0.7766 Intermediate Similarity NPD4202 Approved
0.7711 Intermediate Similarity NPD4808 Clinical (unspecified phase)
0.7711 Intermediate Similarity NPD4809 Clinical (unspecified phase)
0.7683 Intermediate Similarity NPD3699 Clinical (unspecified phase)
0.7683 Intermediate Similarity NPD3700 Clinical (unspecified phase)
0.7667 Intermediate Similarity NPD3665 Phase 1
0.7667 Intermediate Similarity NPD3668 Phase 3
0.7667 Intermediate Similarity NPD3133 Approved
0.7667 Intermediate Similarity NPD3666 Approved
0.7653 Intermediate Similarity NPD5285 Approved
0.7653 Intermediate Similarity NPD4700 Approved
0.7653 Intermediate Similarity NPD5286 Approved
0.7653 Intermediate Similarity NPD4696 Approved
0.7634 Intermediate Similarity NPD4753 Phase 2
0.7579 Intermediate Similarity NPD6399 Phase 3
0.7558 Intermediate Similarity NPD6117 Approved
0.7556 Intermediate Similarity NPD4788 Approved
0.7526 Intermediate Similarity NPD5220 Clinical (unspecified phase)
0.7526 Intermediate Similarity NPD4697 Phase 3
0.7526 Intermediate Similarity NPD5221 Approved
0.7526 Intermediate Similarity NPD5222 Approved
0.75 Intermediate Similarity NPD5225 Approved
0.75 Intermediate Similarity NPD5211 Phase 2
0.75 Intermediate Similarity NPD7748 Approved
0.75 Intermediate Similarity NPD3574 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD4633 Approved
0.75 Intermediate Similarity NPD5226 Approved
0.75 Intermediate Similarity NPD5224 Approved
0.7471 Intermediate Similarity NPD6116 Phase 1
0.747 Intermediate Similarity NPD4267 Clinical (unspecified phase)
0.7451 Intermediate Similarity NPD6675 Approved
0.7451 Intermediate Similarity NPD7128 Approved
0.7451 Intermediate Similarity NPD6402 Approved
0.7451 Intermediate Similarity NPD5739 Approved
0.7449 Intermediate Similarity NPD5173 Approved
0.7442 Intermediate Similarity NPD3703 Phase 2
0.7426 Intermediate Similarity NPD5174 Approved
0.7426 Intermediate Similarity NPD5175 Approved
0.74 Intermediate Similarity NPD5223 Approved
0.7386 Intermediate Similarity NPD6115 Approved
0.7386 Intermediate Similarity NPD3617 Approved
0.7386 Intermediate Similarity NPD6118 Approved
0.7386 Intermediate Similarity NPD6114 Approved
0.7386 Intermediate Similarity NPD6697 Approved
0.7381 Intermediate Similarity NPD4244 Approved
0.7381 Intermediate Similarity NPD4245 Approved
0.7353 Intermediate Similarity NPD5141 Approved
0.7349 Intermediate Similarity NPD5361 Clinical (unspecified phase)
0.7349 Intermediate Similarity NPD5360 Phase 3
0.7333 Intermediate Similarity NPD4634 Approved
0.7326 Intermediate Similarity NPD6113 Clinical (unspecified phase)
0.7308 Intermediate Similarity NPD6881 Approved
0.7308 Intermediate Similarity NPD7320 Approved
0.7308 Intermediate Similarity NPD6899 Approved
0.7303 Intermediate Similarity NPD7645 Phase 2
0.7292 Intermediate Similarity NPD8034 Phase 2
0.7292 Intermediate Similarity NPD8035 Phase 2
0.7282 Intermediate Similarity NPD4768 Approved
0.7282 Intermediate Similarity NPD4767 Approved
0.7273 Intermediate Similarity NPD6084 Phase 2
0.7273 Intermediate Similarity NPD7902 Approved
0.7273 Intermediate Similarity NPD6083 Phase 2
0.7262 Intermediate Similarity NPD3698 Phase 2
0.7255 Intermediate Similarity NPD4754 Approved
0.7253 Intermediate Similarity NPD4223 Phase 3
0.7253 Intermediate Similarity NPD4221 Approved
0.7248 Intermediate Similarity NPD7115 Discovery
0.7245 Intermediate Similarity NPD5210 Approved
0.7245 Intermediate Similarity NPD4629 Approved
0.7241 Intermediate Similarity NPD7339 Approved
0.7241 Intermediate Similarity NPD6942 Approved
0.7238 Intermediate Similarity NPD6373 Approved
0.7238 Intermediate Similarity NPD6372 Approved
0.7212 Intermediate Similarity NPD5697 Approved
0.7212 Intermediate Similarity NPD5701 Approved
0.7204 Intermediate Similarity NPD5329 Approved
0.72 Intermediate Similarity NPD7638 Approved
0.7196 Intermediate Similarity NPD8297 Approved
0.7176 Intermediate Similarity NPD4789 Approved
0.717 Intermediate Similarity NPD6883 Approved
0.717 Intermediate Similarity NPD7102 Approved
0.717 Intermediate Similarity NPD7290 Approved
0.7159 Intermediate Similarity NPD3701 Clinical (unspecified phase)
0.7159 Intermediate Similarity NPD6933 Approved
0.7143 Intermediate Similarity NPD4692 Approved
0.7143 Intermediate Similarity NPD5128 Approved
0.7143 Intermediate Similarity NPD4730 Approved
0.7143 Intermediate Similarity NPD4139 Approved
0.7143 Intermediate Similarity NPD4729 Approved
0.7129 Intermediate Similarity NPD7640 Approved
0.7129 Intermediate Similarity NPD7639 Approved
0.7128 Intermediate Similarity NPD5279 Phase 3
0.7103 Intermediate Similarity NPD8130 Phase 1
0.7103 Intermediate Similarity NPD6869 Approved
0.7103 Intermediate Similarity NPD6617 Approved
0.7103 Intermediate Similarity NPD6649 Approved
0.7103 Intermediate Similarity NPD6847 Approved
0.7103 Intermediate Similarity NPD6650 Approved
0.7097 Intermediate Similarity NPD4197 Approved
0.7075 Intermediate Similarity NPD4061 Clinical (unspecified phase)
0.7075 Intermediate Similarity NPD6013 Approved
0.7075 Intermediate Similarity NPD6012 Approved
0.7075 Intermediate Similarity NPD8132 Clinical (unspecified phase)
0.7075 Intermediate Similarity NPD6014 Approved
0.7048 Intermediate Similarity NPD6412 Phase 2
0.7037 Intermediate Similarity NPD6882 Approved
0.7033 Intermediate Similarity NPD4748 Discontinued
0.7033 Intermediate Similarity NPD4695 Discontinued
0.7009 Intermediate Similarity NPD5248 Approved
0.7009 Intermediate Similarity NPD5249 Phase 3
0.7009 Intermediate Similarity NPD5247 Approved
0.7009 Intermediate Similarity NPD5251 Approved
0.7009 Intermediate Similarity NPD5250 Approved
0.7 Intermediate Similarity NPD3671 Phase 1
0.699 Remote Similarity NPD7632 Discontinued
0.6988 Remote Similarity NPD3171 Clinical (unspecified phase)
0.6981 Remote Similarity NPD6011 Approved
0.6979 Remote Similarity NPD7513 Clinical (unspecified phase)
0.6972 Remote Similarity NPD4632 Approved
0.697 Remote Similarity NPD7901 Clinical (unspecified phase)
0.697 Remote Similarity NPD7900 Approved
0.6947 Remote Similarity NPD4623 Approved
0.6947 Remote Similarity NPD4693 Phase 3
0.6947 Remote Similarity NPD4519 Discontinued
0.6947 Remote Similarity NPD7334 Approved
0.6947 Remote Similarity NPD6684 Approved
0.6947 Remote Similarity NPD4689 Approved
0.6947 Remote Similarity NPD4690 Approved
0.6947 Remote Similarity NPD6409 Approved
0.6947 Remote Similarity NPD7521 Approved
0.6947 Remote Similarity NPD5205 Approved
0.6947 Remote Similarity NPD5330 Approved
0.6947 Remote Similarity NPD4688 Approved
0.6947 Remote Similarity NPD7146 Approved
0.6947 Remote Similarity NPD4138 Approved
0.6944 Remote Similarity NPD5216 Approved
0.6944 Remote Similarity NPD5215 Approved
0.6944 Remote Similarity NPD6401 Clinical (unspecified phase)
0.6944 Remote Similarity NPD5217 Approved
0.6932 Remote Similarity NPD6924 Approved
0.6932 Remote Similarity NPD6926 Approved
0.6907 Remote Similarity NPD7285 Clinical (unspecified phase)
0.69 Remote Similarity NPD5695 Phase 3
0.6897 Remote Similarity NPD4758 Discontinued
0.6863 Remote Similarity NPD5696 Approved
0.6863 Remote Similarity NPD4225 Approved
0.6852 Remote Similarity NPD5134 Clinical (unspecified phase)
0.6852 Remote Similarity NPD5135 Approved
0.6852 Remote Similarity NPD5169 Approved
0.6848 Remote Similarity NPD7509 Discontinued
0.6822 Remote Similarity NPD5168 Approved
0.6813 Remote Similarity NPD5364 Discontinued
0.6804 Remote Similarity NPD6672 Approved
0.6804 Remote Similarity NPD6903 Approved
0.6804 Remote Similarity NPD5737 Approved
0.6789 Remote Similarity NPD5127 Approved
0.6786 Remote Similarity NPD8295 Clinical (unspecified phase)
0.6771 Remote Similarity NPD5690 Phase 2
0.6771 Remote Similarity NPD5280 Approved
0.6771 Remote Similarity NPD4694 Approved
0.6768 Remote Similarity NPD6411 Approved
0.6754 Remote Similarity NPD6059 Approved
0.6754 Remote Similarity NPD6054 Approved
0.6754 Remote Similarity NPD6319 Approved
0.6733 Remote Similarity NPD6356 Clinical (unspecified phase)
0.6705 Remote Similarity NPD6081 Approved
0.6701 Remote Similarity NPD7524 Approved
0.6697 Remote Similarity NPD5955 Clinical (unspecified phase)
0.6696 Remote Similarity NPD6274 Approved
0.6667 Remote Similarity NPD6930 Phase 2
0.6667 Remote Similarity NPD5345 Clinical (unspecified phase)
0.6667 Remote Similarity NPD7100 Approved
0.6667 Remote Similarity NPD7101 Approved
0.6667 Remote Similarity NPD6931 Approved
0.6638 Remote Similarity NPD6370 Approved
0.6637 Remote Similarity NPD6009 Approved
0.6636 Remote Similarity NPD6008 Approved
0.6632 Remote Similarity NPD6695 Phase 3
0.661 Remote Similarity NPD7507 Approved
0.6607 Remote Similarity NPD5167 Approved
0.66 Remote Similarity NPD5281 Approved
0.66 Remote Similarity NPD5284 Approved
0.6598 Remote Similarity NPD6098 Approved
0.6579 Remote Similarity NPD6335 Approved
0.6571 Remote Similarity NPD4159 Approved
0.6566 Remote Similarity NPD6080 Approved
0.6566 Remote Similarity NPD6904 Approved
0.6566 Remote Similarity NPD6101 Approved
0.6566 Remote Similarity NPD6673 Approved
0.6566 Remote Similarity NPD5764 Clinical (unspecified phase)
0.6562 Remote Similarity NPD7338 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   44335365
ChEMBL   CHEMBL102361
ZINC  

Physicochemical Properties

Molecular Weight:  490.37
ALogP:  0.8749
MLogP:  4.21
XLogP:  3.911
# Rotatable Bonds:  17
Polar Surface Area:  97.99
# H-Bond Aceptor:  5
# H-Bond Donor:  4
# Rings:  4
# Heavy Atoms:  35

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
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Biological Activities  
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