Natural Product: NPC477474

Natural Product ID:  NPC477474
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C76H112O33
Standard InCHIKey:  OECODFGEYAGOCZ-WSENZWEMSA-N
Standard InCHI:  InChI=1S/C76H112O33/c1-13-31(2)63(94)108-60-61(102-43(80)20-19-35-17-15-14-16-18-35)76-40(27-70(60,6)7)75(109-69(76)95)26-22-39-72(10)24-23-41(71(8,9)38(72)21-25-73(39,11)74(75,12)28-42(76)98-34(5)79)101-68-59(107-65-53(90)49(86)46(83)36(29-77)99-65)55(54(91)56(104-68)62(92)93)103-67-58(51(88)47(84)37(30-78)100-67)106-66-57(50(87)45(82)33(4)97-66)105-64-52(89)48(85)44(81)32(3)96-64/h13-20,32-33,36-42,44-61,64-69,77-78,81-91,95H,21-30H2,1-12H3,(H,92,93)/b20-19+,31-13-/t32-,33-,36?,37?,38?,39?,40?,41-,42+,44-,45?,46+,47-,48?,49?,50-,51?,52-,53-,54-,55?,56?,57?,58-,59-,60-,61-,64?,65-,66?,67-,68+,69-,72-,73+,74-,75-,76+/m0/s1
Canonical SMILES:  OCC1O[C@@H](O[C@@H]2[C@@H](OC([C@H](C2O[C@@H]2OC(CO)[C@@H](C([C@@H]2OC2O[C@@H](C)C([C@@H](C2OC2O[C@@H](C)[C@@H](C([C@@H]2O)O)O)O)O)O)O)O)C(=O)O)O[C@H]2CC[C@]3(C(C2(C)C)CC[C@@]2(C3CC[C@]34[C@@]2(C)C[C@H]([C@@]2(C4CC(C)(C)[C@H]([C@@H]2OC(=O)/C=C/c2ccccc2)OC(=O)/C(=CC)/C)[C@H](O3)O)OC(=O)C)C)C)[C@H](C([C@@H]1O)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
NPO22350 Maesa balansae Species Primulaceae Eukaryota Leaves Deo Khe, Dai Tu district, Thai Nguyen province in Vietnam 2000-NOV PMID[15633999]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT1021 Organism Leishmania infantum Leishmania infantum IC50 = 0.041 ug/ml 15633999
NPT1021 Organism Leishmania infantum Leishmania infantum IC90 = 0.125 ug/ml 15633999
NPT171 Cell Line MRC5 Homo sapiens CC50 = 8 ug/ml 15633999

  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 NPC477474 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 NPC477472
1.0 High Similarity NPC477470
0.9932 High Similarity NPC477467
0.9527 High Similarity NPC69425
0.9392 High Similarity NPC329657
0.9359 High Similarity NPC477466
0.9359 High Similarity NPC477471
0.9359 High Similarity NPC477469
0.9359 High Similarity NPC477473
0.9054 High Similarity NPC264270
0.9054 High Similarity NPC40085
0.9038 High Similarity NPC150893
0.9038 High Similarity NPC295408
0.9038 High Similarity NPC329960
0.8986 High Similarity NPC111466
0.8917 High Similarity NPC475437
0.8917 High Similarity NPC473641
0.8917 High Similarity NPC475300
0.8917 High Similarity NPC475464
0.8917 High Similarity NPC475505
0.8917 High Similarity NPC473797
0.8854 High Similarity NPC165234
0.8854 High Similarity NPC475536
0.8851 High Similarity NPC473755
0.8851 High Similarity NPC475513
0.8696 High Similarity NPC102465
0.8662 High Similarity NPC477736
0.8599 High Similarity NPC477735
0.8553 High Similarity NPC301946
0.8553 High Similarity NPC277053
0.8487 Intermediate Similarity NPC80895
0.8487 Intermediate Similarity NPC471912
0.8466 Intermediate Similarity NPC469420
0.8452 Intermediate Similarity NPC475218
0.8452 Intermediate Similarity NPC476092
0.8452 Intermediate Similarity NPC475447
0.8452 Intermediate Similarity NPC70236
0.8428 Intermediate Similarity NPC471102
0.8428 Intermediate Similarity NPC469399
0.8418 Intermediate Similarity NPC106895
0.8415 Intermediate Similarity NPC477488
0.8387 Intermediate Similarity NPC474564
0.8383 Intermediate Similarity NPC124828
0.8373 Intermediate Similarity NPC469421
0.8367 Intermediate Similarity NPC476976
0.8365 Intermediate Similarity NPC469417
0.8354 Intermediate Similarity NPC228204
0.8354 Intermediate Similarity NPC26033
0.8354 Intermediate Similarity NPC282239
0.8354 Intermediate Similarity NPC472549
0.8344 Intermediate Similarity NPC477905
0.8299 Intermediate Similarity NPC476977
0.8293 Intermediate Similarity NPC475198
0.8293 Intermediate Similarity NPC475531
0.8293 Intermediate Similarity NPC475175
0.8291 Intermediate Similarity NPC469477
0.8291 Intermediate Similarity NPC249471
0.8291 Intermediate Similarity NPC304876
0.8291 Intermediate Similarity NPC237549
0.8291 Intermediate Similarity NPC472030
0.8291 Intermediate Similarity NPC473414
0.8291 Intermediate Similarity NPC133430
0.8291 Intermediate Similarity NPC257213
0.8291 Intermediate Similarity NPC1173
0.8291 Intermediate Similarity NPC242262
0.8291 Intermediate Similarity NPC265395
0.8291 Intermediate Similarity NPC256142
0.8291 Intermediate Similarity NPC472022
0.8291 Intermediate Similarity NPC158333
0.8291 Intermediate Similarity NPC472005
0.8282 Intermediate Similarity NPC471493
0.828 Intermediate Similarity NPC471103
0.828 Intermediate Similarity NPC51602
0.8261 Intermediate Similarity NPC477623
0.825 Intermediate Similarity NPC472393
0.8239 Intermediate Similarity NPC114410
0.8239 Intermediate Similarity NPC5115
0.8239 Intermediate Similarity NPC112523
0.8232 Intermediate Similarity NPC475567
0.8232 Intermediate Similarity NPC473557
0.8232 Intermediate Similarity NPC477491
0.8232 Intermediate Similarity NPC473468
0.8228 Intermediate Similarity NPC472548
0.8225 Intermediate Similarity NPC475649
0.8217 Intermediate Similarity NPC7095
0.8214 Intermediate Similarity NPC13989
0.8187 Intermediate Similarity NPC217091
0.8176 Intermediate Similarity NPC77719
0.8176 Intermediate Similarity NPC475613
0.8166 Intermediate Similarity NPC475345
0.8165 Intermediate Similarity NPC470153
0.816 Intermediate Similarity NPC275477
0.8153 Intermediate Similarity NPC250046
0.8153 Intermediate Similarity NPC60509
0.8153 Intermediate Similarity NPC476975
0.8153 Intermediate Similarity NPC81698
0.8137 Intermediate Similarity NPC469771
0.8125 Intermediate Similarity NPC21410
0.8125 Intermediate Similarity NPC469398
0.8125 Intermediate Similarity NPC473670
0.811 Intermediate Similarity NPC66193
0.8101 Intermediate Similarity NPC112216
0.8101 Intermediate Similarity NPC161239
0.8101 Intermediate Similarity NPC473214
0.8101 Intermediate Similarity NPC470245
0.8101 Intermediate Similarity NPC198455
0.8101 Intermediate Similarity NPC254558
0.8101 Intermediate Similarity NPC469448
0.8101 Intermediate Similarity NPC165260
0.8095 Intermediate Similarity NPC478154
0.8095 Intermediate Similarity NPC312650
0.8086 Intermediate Similarity NPC476784
0.8086 Intermediate Similarity NPC49297
0.8061 Intermediate Similarity NPC471134
0.8047 Intermediate Similarity NPC476113
0.8041 Intermediate Similarity NPC471024
0.8041 Intermediate Similarity NPC478151
0.8041 Intermediate Similarity NPC225791
0.8038 Intermediate Similarity NPC301556
0.8038 Intermediate Similarity NPC266265
0.8038 Intermediate Similarity NPC270590
0.8038 Intermediate Similarity NPC473215
0.8038 Intermediate Similarity NPC92293
0.8038 Intermediate Similarity NPC471101
0.8027 Intermediate Similarity NPC92283
0.8027 Intermediate Similarity NPC476971
0.8027 Intermediate Similarity NPC25998
0.8027 Intermediate Similarity NPC63404
0.8027 Intermediate Similarity NPC124878
0.8027 Intermediate Similarity NPC476972
0.8027 Intermediate Similarity NPC231888
0.8027 Intermediate Similarity NPC204214
0.8027 Intermediate Similarity NPC476775
0.8027 Intermediate Similarity NPC35338
0.8027 Intermediate Similarity NPC198918
0.8027 Intermediate Similarity NPC290276
0.8027 Intermediate Similarity NPC271610
0.8027 Intermediate Similarity NPC476780
0.8027 Intermediate Similarity NPC476774
0.8027 Intermediate Similarity NPC10883
0.8027 Intermediate Similarity NPC478155
0.8027 Intermediate Similarity NPC10121
0.8025 Intermediate Similarity NPC181924
0.8025 Intermediate Similarity NPC477737
0.8012 Intermediate Similarity NPC34066
0.8012 Intermediate Similarity NPC469422
0.8012 Intermediate Similarity NPC61891
0.7988 Intermediate Similarity NPC476077
0.7976 Intermediate Similarity NPC278272
0.7976 Intermediate Similarity NPC120667
0.7975 Intermediate Similarity NPC281717
0.7974 Intermediate Similarity NPC184109
0.7973 Intermediate Similarity NPC478153
0.7973 Intermediate Similarity NPC478152
0.7973 Intermediate Similarity NPC192765
0.7973 Intermediate Similarity NPC46823
0.7973 Intermediate Similarity NPC178264
0.7973 Intermediate Similarity NPC473918
0.7973 Intermediate Similarity NPC71391
0.7973 Intermediate Similarity NPC476776
0.7973 Intermediate Similarity NPC471025
0.7973 Intermediate Similarity NPC478150
0.7973 Intermediate Similarity NPC277212
0.7973 Intermediate Similarity NPC30279
0.7962 Intermediate Similarity NPC470159
0.7962 Intermediate Similarity NPC70403
0.7962 Intermediate Similarity NPC472572
0.7962 Intermediate Similarity NPC174982
0.7962 Intermediate Similarity NPC471100
0.7962 Intermediate Similarity NPC473088
0.7962 Intermediate Similarity NPC471107
0.7962 Intermediate Similarity NPC472568
0.7962 Intermediate Similarity NPC200471
0.7962 Intermediate Similarity NPC127857
0.7962 Intermediate Similarity NPC472575
0.7962 Intermediate Similarity NPC476973
0.7962 Intermediate Similarity NPC158663
0.7962 Intermediate Similarity NPC177940
0.7962 Intermediate Similarity NPC171525
0.7962 Intermediate Similarity NPC471104
0.7962 Intermediate Similarity NPC472571
0.7962 Intermediate Similarity NPC469349
0.7962 Intermediate Similarity NPC470157
0.7962 Intermediate Similarity NPC96903
0.7962 Intermediate Similarity NPC184817
0.7962 Intermediate Similarity NPC29704
0.7959 Intermediate Similarity NPC141600
0.7959 Intermediate Similarity NPC280029
0.7959 Intermediate Similarity NPC470518
0.7959 Intermediate Similarity NPC244296
0.7959 Intermediate Similarity NPC82380
0.7959 Intermediate Similarity NPC47995
0.7959 Intermediate Similarity NPC269484
0.7959 Intermediate Similarity NPC77651
0.7959 Intermediate Similarity NPC1314
0.7959 Intermediate Similarity NPC28069
0.7959 Intermediate Similarity NPC470158
0.7959 Intermediate Similarity NPC88311
0.7959 Intermediate Similarity NPC472267
0.7959 Intermediate Similarity NPC252657

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC477474 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
0.8188 Intermediate Similarity NPD7966 Clinical (unspecified phase)
0.7824 Intermediate Similarity NPD7799 Discontinued
0.7614 Intermediate Similarity NPD8407 Phase 2
0.7543 Intermediate Similarity NPD8368 Discontinued
0.7383 Intermediate Similarity NPD8328 Phase 3
0.7371 Intermediate Similarity NPD8470 Clinical (unspecified phase)
0.7363 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7253 Intermediate Similarity NPD8435 Approved
0.7195 Intermediate Similarity NPD7236 Approved
0.7182 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.7181 Intermediate Similarity NPD8486 Clinical (unspecified phase)
0.7167 Intermediate Similarity NPD8313 Approved
0.7167 Intermediate Similarity NPD8312 Approved
0.7158 Intermediate Similarity NPD8361 Approved
0.7158 Intermediate Similarity NPD8360 Approved
0.7143 Intermediate Similarity NPD8434 Phase 2
0.7133 Intermediate Similarity NPD8516 Approved
0.7133 Intermediate Similarity NPD8515 Approved
0.7133 Intermediate Similarity NPD8517 Approved
0.712 Intermediate Similarity NPD8319 Approved
0.712 Intermediate Similarity NPD8320 Phase 1
0.7083 Intermediate Similarity NPD7239 Suspended
0.7049 Intermediate Similarity NPD8424 Clinical (unspecified phase)
0.7021 Intermediate Similarity NPD8485 Approved
0.702 Intermediate Similarity NPD8513 Phase 3
0.6984 Remote Similarity NPD7699 Phase 2
0.6984 Remote Similarity NPD7700 Phase 2
0.6981 Remote Similarity NPD7961 Discontinued
0.698 Remote Similarity NPD8295 Clinical (unspecified phase)
0.6957 Remote Similarity NPD8150 Discontinued
0.6927 Remote Similarity NPD7228 Approved
0.6905 Remote Similarity NPD8389 Clinical (unspecified phase)
0.6891 Remote Similarity NPD7435 Discontinued
0.6879 Remote Similarity NPD8455 Phase 2
0.6868 Remote Similarity NPD7240 Approved
0.6859 Remote Similarity NPD7736 Approved
0.6826 Remote Similarity NPD6190 Approved
0.6825 Remote Similarity NPD6534 Approved
0.6825 Remote Similarity NPD6535 Approved
0.6815 Remote Similarity NPD7319 Approved
0.6798 Remote Similarity NPD3787 Discontinued
0.6796 Remote Similarity NPD7804 Clinical (unspecified phase)
0.6788 Remote Similarity NPD7266 Discontinued
0.6768 Remote Similarity NPD7875 Clinical (unspecified phase)
0.6768 Remote Similarity NPD7874 Approved
0.6766 Remote Similarity NPD8166 Discontinued
0.675 Remote Similarity NPD5952 Clinical (unspecified phase)
0.674 Remote Similarity NPD3751 Discontinued
0.6739 Remote Similarity NPD7808 Phase 3
0.6732 Remote Similarity NPD8377 Approved
0.6732 Remote Similarity NPD8294 Approved
0.6731 Remote Similarity NPD7507 Approved
0.6718 Remote Similarity NPD7696 Phase 3
0.6718 Remote Similarity NPD7698 Approved
0.6718 Remote Similarity NPD7697 Approved
0.6705 Remote Similarity NPD7058 Phase 2
0.6705 Remote Similarity NPD7057 Phase 3
0.6702 Remote Similarity NPD8397 Clinical (unspecified phase)
0.6688 Remote Similarity NPD8380 Approved
0.6688 Remote Similarity NPD8296 Approved
0.6688 Remote Similarity NPD8378 Approved
0.6688 Remote Similarity NPD8379 Approved
0.6688 Remote Similarity NPD8335 Approved
0.6685 Remote Similarity NPD7251 Discontinued
0.6684 Remote Similarity NPD7871 Phase 2
0.6684 Remote Similarity NPD7870 Phase 2
0.6667 Remote Similarity NPD8133 Approved
0.6667 Remote Similarity NPD7701 Phase 2
0.6649 Remote Similarity NPD6776 Approved
0.6649 Remote Similarity NPD6782 Approved
0.6649 Remote Similarity NPD6778 Approved
0.6649 Remote Similarity NPD6777 Approved
0.6649 Remote Similarity NPD6781 Approved
0.6649 Remote Similarity NPD6780 Approved
0.6649 Remote Similarity NPD6779 Approved
0.6648 Remote Similarity NPD8127 Discontinued
0.6647 Remote Similarity NPD7458 Discontinued
0.6645 Remote Similarity NPD5125 Phase 3
0.6645 Remote Similarity NPD5126 Approved
0.6645 Remote Similarity NPD4198 Discontinued
0.6633 Remote Similarity NPD8151 Discontinued
0.663 Remote Similarity NPD6797 Phase 2
0.6629 Remote Similarity NPD37 Approved
0.6623 Remote Similarity NPD6010 Discontinued
0.661 Remote Similarity NPD4965 Approved
0.661 Remote Similarity NPD4966 Approved
0.661 Remote Similarity NPD4967 Phase 2
0.6595 Remote Similarity NPD7685 Pre-registration
0.6581 Remote Similarity NPD8033 Approved
0.6581 Remote Similarity NPD7503 Approved
0.6576 Remote Similarity NPD7074 Phase 3
0.6567 Remote Similarity NPD7783 Phase 2
0.6567 Remote Similarity NPD7801 Approved
0.6567 Remote Similarity NPD7782 Clinical (unspecified phase)
0.6559 Remote Similarity NPD4338 Clinical (unspecified phase)
0.6558 Remote Similarity NPD7516 Approved
0.6554 Remote Similarity NPD6686 Approved
0.6538 Remote Similarity NPD6370 Approved
0.6536 Remote Similarity NPD6234 Discontinued
0.6535 Remote Similarity NPD8462 Phase 1
0.6533 Remote Similarity NPD8413 Clinical (unspecified phase)
0.6522 Remote Similarity NPD8155 Clinical (unspecified phase)
0.6494 Remote Similarity NPD7327 Approved
0.6494 Remote Similarity NPD7328 Approved
0.6486 Remote Similarity NPD7472 Approved
0.6484 Remote Similarity NPD7184 Clinical (unspecified phase)
0.6478 Remote Similarity NPD8293 Discontinued
0.6471 Remote Similarity NPD2629 Approved
0.6456 Remote Similarity NPD7492 Approved
0.6452 Remote Similarity NPD7993 Clinical (unspecified phase)
0.6443 Remote Similarity NPD5345 Clinical (unspecified phase)
0.6433 Remote Similarity NPD7274 Clinical (unspecified phase)
0.6432 Remote Similarity NPD7054 Approved
0.6425 Remote Similarity NPD6212 Phase 3
0.6425 Remote Similarity NPD6213 Phase 3
0.6425 Remote Similarity NPD6214 Clinical (unspecified phase)
0.6419 Remote Similarity NPD5048 Discontinued
0.6415 Remote Similarity NPD6616 Approved
0.641 Remote Similarity NPD6054 Approved
0.6408 Remote Similarity NPD8404 Phase 2
0.6407 Remote Similarity NPD7097 Phase 1
0.6404 Remote Similarity NPD7096 Clinical (unspecified phase)
0.6389 Remote Similarity NPD7075 Discontinued
0.6389 Remote Similarity NPD4381 Clinical (unspecified phase)
0.6378 Remote Similarity NPD3818 Discontinued
0.6375 Remote Similarity NPD7078 Approved
0.6374 Remote Similarity NPD7199 Phase 2
0.634 Remote Similarity NPD7094 Approved
0.634 Remote Similarity NPD6858 Approved
0.6332 Remote Similarity NPD6823 Phase 2
0.633 Remote Similarity NPD6559 Discontinued
0.6318 Remote Similarity NPD7211 Clinical (unspecified phase)
0.6306 Remote Similarity NPD6319 Approved
0.6306 Remote Similarity NPD7741 Discontinued
0.63 Remote Similarity NPD7680 Approved
0.6291 Remote Similarity NPD8132 Clinical (unspecified phase)
0.6279 Remote Similarity NPD4628 Phase 3
0.6273 Remote Similarity NPD8074 Phase 3
0.627 Remote Similarity NPD6167 Clinical (unspecified phase)
0.627 Remote Similarity NPD6166 Phase 2
0.627 Remote Similarity NPD6168 Clinical (unspecified phase)
0.6266 Remote Similarity NPD6015 Approved
0.6266 Remote Similarity NPD6016 Approved
0.6264 Remote Similarity NPD5537 Clinical (unspecified phase)
0.6264 Remote Similarity NPD6143 Clinical (unspecified phase)
0.6263 Remote Similarity NPD7237 Clinical (unspecified phase)
0.6257 Remote Similarity NPD5844 Phase 1
0.625 Remote Similarity NPD2067 Discontinued
0.6236 Remote Similarity NPD6599 Discontinued
0.623 Remote Similarity NPD5494 Approved
0.6229 Remote Similarity NPD7004 Clinical (unspecified phase)
0.6226 Remote Similarity NPD5988 Approved
0.6226 Remote Similarity NPD5619 Clinical (unspecified phase)
0.6222 Remote Similarity NPD5761 Phase 2
0.6222 Remote Similarity NPD7819 Suspended
0.6222 Remote Similarity NPD5760 Phase 2
0.6221 Remote Similarity NPD6674 Discontinued
0.6219 Remote Similarity NPD7497 Discontinued
0.6203 Remote Similarity NPD6059 Approved
0.6188 Remote Similarity NPD5402 Approved
0.6174 Remote Similarity NPD6647 Phase 2
0.6169 Remote Similarity NPD969 Suspended
0.6169 Remote Similarity NPD8297 Approved
0.6169 Remote Similarity NPD6882 Approved
0.6167 Remote Similarity NPD6801 Discontinued
0.6159 Remote Similarity NPD6007 Clinical (unspecified phase)
0.6159 Remote Similarity NPD6685 Approved
0.6158 Remote Similarity NPD6765 Approved
0.6158 Remote Similarity NPD6764 Approved
0.6154 Remote Similarity NPD4868 Clinical (unspecified phase)
0.615 Remote Similarity NPD7473 Discontinued
0.6145 Remote Similarity NPD4380 Phase 2
0.6145 Remote Similarity NPD7008 Discontinued
0.6139 Remote Similarity NPD7610 Discontinued
0.6115 Remote Similarity NPD3317 Approved
0.6115 Remote Similarity NPD7115 Discovery
0.6115 Remote Similarity NPD6009 Approved
0.6105 Remote Similarity NPD5762 Approved
0.6105 Remote Similarity NPD5763 Approved
0.6102 Remote Similarity NPD6273 Approved
0.6099 Remote Similarity NPD3817 Phase 2
0.6095 Remote Similarity NPD6355 Discontinued
0.6087 Remote Similarity NPD7457 Clinical (unspecified phase)
0.6075 Remote Similarity NPD6232 Discontinued
0.6067 Remote Similarity NPD6980 Clinical (unspecified phase)
0.6062 Remote Similarity NPD6921 Approved
0.6056 Remote Similarity NPD7028 Phase 2
0.6048 Remote Similarity NPD7095 Approved
0.6031 Remote Similarity NPD6785 Approved
0.6031 Remote Similarity NPD6784 Approved
0.6024 Remote Similarity NPD5736 Approved
0.6022 Remote Similarity NPD6959 Discontinued
0.6014 Remote Similarity NPD4225 Approved
0.6012 Remote Similarity NPD3764 Approved
0.6011 Remote Similarity NPD8443 Clinical (unspecified phase)
0.6011 Remote Similarity NPD7852 Clinical (unspecified phase)
0.6 Remote Similarity NPD4141 Clinical (unspecified phase)
0.6 Remote Similarity NPD7999 Approved
0.6 Remote Similarity NPD7003 Approved
0.6 Remote Similarity NPD7930 Approved

Structure

External Identifiers

PubChem CID   44388738
ChEMBL   CHEMBL405516
ZINC  

Physicochemical Properties

Molecular Weight:  1552.71
ALogP:  -4.6436
MLogP:  6.19
XLogP:  6.087
# Rotatable Bonds:  49
Polar Surface Area:  500.95
# H-Bond Aceptor:  33
# H-Bond Donor:  15
# Rings:  12
# Heavy Atoms:  109

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