Natural Product: NPC269297

Natural Product ID:  NPC269297
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C51H82O20
Standard InCHIKey:  OZIHYFWYFUSXIS-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C51H82O20/c1-20-10-15-51(62-19-20)21(2)32-30(71-51)17-29-27-9-8-25-16-26(11-13-49(25,6)28(27)12-14-50(29,32)7)66-48-44(70-46-39(59)36(56)34(54)23(4)64-46)41(61)43(31(18-52)67-48)69-47-40(60)37(57)42(24(5)65-47)68-45-38(58)35(55)33(53)22(3)63-45/h8,20-24,26-48,52-61H,9-19H2,1-7H3
Canonical SMILES:  OCC1OC(OC2CCC3(C(=CCC4C3CCC3(C4CC4C3C(C)C3(O4)CCC(CO3)C)C)C2)C)C(C(C1OC1OC(C)C(C(C1O)O)OC1OC(C)C(C(C1O)O)O)O)OC1OC(C)C(C(C1O)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
NPO27472 Daiswa polyphylla Species Melanthiaceae Eukaryota TCMID*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT367 Cell Line MDA-N Homo sapiens GI50 399.94 nM PubChem BioAssay data set
NPT368 Cell Line SN12C Homo sapiens GI50 267.3 nM PubChem BioAssay data set
NPT370 Cell Line NCI-H23 Homo sapiens GI50 1663.41 nM PubChem BioAssay data set
NPT371 Cell Line UO-31 Homo sapiens GI50 215.77 nM PubChem BioAssay data set
NPT369 Cell Line ACHN Homo sapiens GI50 1472.31 nM PubChem BioAssay data set
NPT372 Cell Line HOP-92 Homo sapiens GI50 70.31 nM PubChem BioAssay data set
NPT116 Cell Line HL-60 Homo sapiens GI50 239.33 nM PubChem BioAssay data set
NPT374 Cell Line SF-539 Homo sapiens GI50 393.55 nM PubChem BioAssay data set
NPT90 Cell Line DU-145 Homo sapiens GI50 1279.38 nM PubChem BioAssay data set
NPT373 Cell Line SK-MEL-5 Homo sapiens GI50 1425.61 nM PubChem BioAssay data set
NPT375 Cell Line Malme-3M Homo sapiens GI50 363.08 nM PubChem BioAssay data set
NPT111 Cell Line K562 Homo sapiens GI50 141.91 nM PubChem BioAssay data set
NPT377 Cell Line OVCAR-3 Homo sapiens GI50 1745.82 nM PubChem BioAssay data set
NPT376 Cell Line A498 Homo sapiens GI50 291.07 nM PubChem BioAssay data set
NPT379 Cell Line HOP-62 Homo sapiens GI50 2558.59 nM PubChem BioAssay data set
NPT112 Cell Line MOLT-4 Homo sapiens GI50 237.14 nM PubChem BioAssay data set
NPT380 Cell Line U-251 Homo sapiens GI50 650.13 nM PubChem BioAssay data set
NPT381 Cell Line OVCAR-8 Homo sapiens GI50 325.84 nM PubChem BioAssay data set
NPT382 Cell Line OVCAR-5 Homo sapiens GI50 1124.6 nM PubChem BioAssay data set
NPT383 Cell Line SNB-19 Homo sapiens GI50 262.42 nM PubChem BioAssay data set
NPT385 Cell Line SR Homo sapiens GI50 19.63 nM PubChem BioAssay data set
NPT82 Cell Line MDA-MB-231 Homo sapiens GI50 62.81 nM PubChem BioAssay data set
NPT323 Cell Line SW-620 Homo sapiens GI50 1479.11 nM PubChem BioAssay data set
NPT384 Cell Line TK-10 Homo sapiens GI50 1386.76 nM PubChem BioAssay data set
NPT455 Cell Line NCI-H522 Homo sapiens GI50 642.69 nM PubChem BioAssay data set
NPT387 Cell Line M14 Homo sapiens GI50 1051.96 nM PubChem BioAssay data set
NPT386 Cell Line KM12 Homo sapiens GI50 159.96 nM PubChem BioAssay data set
NPT389 Cell Line RPMI-8226 Homo sapiens GI50 381.94 nM PubChem BioAssay data set
NPT388 Cell Line NCI-H322M Homo sapiens GI50 430.53 nM PubChem BioAssay data set
NPT456 Cell Line OVCAR-4 Homo sapiens GI50 274.79 nM PubChem BioAssay data set
NPT390 Cell Line LOX IMVI Homo sapiens GI50 184.93 nM PubChem BioAssay data set
NPT457 Cell Line BT-549 Homo sapiens GI50 1655.77 nM PubChem BioAssay data set
NPT147 Cell Line SK-MEL-2 Homo sapiens GI50 1210.6 nM PubChem BioAssay data set
NPT81 Cell Line A549 Homo sapiens GI50 311.89 nM PubChem BioAssay data set
NPT392 Cell Line SNB-75 Homo sapiens GI50 372.39 nM PubChem BioAssay data set
NPT391 Cell Line HCC 2998 Homo sapiens GI50 312.61 nM PubChem BioAssay data set
NPT148 Cell Line HCT-15 Homo sapiens GI50 1513.56 nM PubChem BioAssay data set
NPT393 Cell Line HCT-116 Homo sapiens GI50 521.19 nM PubChem BioAssay data set
NPT395 Cell Line SF-268 Homo sapiens GI50 559.76 nM PubChem BioAssay data set
NPT83 Cell Line MCF7 Homo sapiens GI50 1380.38 nM PubChem BioAssay data set
NPT394 Cell Line EKVX Homo sapiens GI50 756.83 nM PubChem BioAssay data set
NPT306 Cell Line PC-3 Homo sapiens GI50 724.44 nM PubChem BioAssay data set
NPT396 Cell Line T47D Homo sapiens GI50 1241.65 nM PubChem BioAssay data set
NPT146 Cell Line SK-OV-3 Homo sapiens GI50 1069.05 nM PubChem BioAssay data set
NPT397 Cell Line NCI-H460 Homo sapiens GI50 1614.36 nM PubChem BioAssay data set
NPT398 Cell Line UACC-62 Homo sapiens GI50 311.17 nM PubChem BioAssay data set
NPT400 Cell Line MDA-MB-435 Homo sapiens GI50 281.19 nM PubChem BioAssay data set
NPT308 Cell Line CAKI-1 Homo sapiens GI50 1288.25 nM PubChem BioAssay data set
NPT458 Cell Line IGROV-1 Homo sapiens GI50 1297.18 nM PubChem BioAssay data set
NPT399 Cell Line SF-295 Homo sapiens GI50 307.61 nM PubChem BioAssay data set
NPT402 Cell Line Hs-578T Homo sapiens GI50 264.24 nM PubChem BioAssay data set
NPT401 Cell Line 786-0 Homo sapiens GI50 1071.52 nM PubChem BioAssay data set
NPT403 Cell Line UACC-257 Homo sapiens GI50 739.61 nM PubChem BioAssay data set
NPT404 Cell Line CCRF-CEM Homo sapiens GI50 64.27 nM PubChem BioAssay data set
NPT405 Cell Line NCI-H226 Homo sapiens GI50 1364.58 nM PubChem BioAssay data set
NPT139 Cell Line HT-29 Homo sapiens GI50 1002.31 nM PubChem BioAssay data set
NPT170 Cell Line SK-MEL-28 Homo sapiens GI50 612.35 nM PubChem BioAssay data set
NPT407 Cell Line COLO 205 Homo sapiens GI50 1279.38 nM PubChem BioAssay data set
NPT406 Cell Line RXF 393 Homo sapiens GI50 583.45 nM PubChem BioAssay data set

  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 NPC269297 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 NPC477811
1.0 High Similarity NPC222202
1.0 High Similarity NPC23808
1.0 High Similarity NPC87998
1.0 High Similarity NPC224314
0.9902 High Similarity NPC13193
0.9901 High Similarity NPC73243
0.9901 High Similarity NPC249265
0.9901 High Similarity NPC84956
0.9901 High Similarity NPC46190
0.9901 High Similarity NPC477809
0.9901 High Similarity NPC150372
0.9901 High Similarity NPC6806
0.9901 High Similarity NPC309278
0.9901 High Similarity NPC102016
0.9901 High Similarity NPC22779
0.9901 High Similarity NPC232054
0.9901 High Similarity NPC224098
0.9901 High Similarity NPC171073
0.9901 High Similarity NPC475550
0.9901 High Similarity NPC95051
0.9901 High Similarity NPC248746
0.9901 High Similarity NPC194207
0.9901 High Similarity NPC470433
0.9901 High Similarity NPC300557
0.9901 High Similarity NPC208383
0.9901 High Similarity NPC218571
0.9901 High Similarity NPC475333
0.9901 High Similarity NPC244086
0.9806 High Similarity NPC244431
0.9806 High Similarity NPC210569
0.9806 High Similarity NPC32361
0.9806 High Similarity NPC263359
0.9806 High Similarity NPC31896
0.9802 High Similarity NPC98696
0.9712 High Similarity NPC79900
0.9709 High Similarity NPC477032
0.9709 High Similarity NPC475247
0.9709 High Similarity NPC476547
0.9709 High Similarity NPC294129
0.9709 High Similarity NPC477028
0.9709 High Similarity NPC124677
0.9703 High Similarity NPC470432
0.9703 High Similarity NPC283829
0.9703 High Similarity NPC230507
0.9703 High Similarity NPC14704
0.9703 High Similarity NPC305423
0.9703 High Similarity NPC161676
0.9703 High Similarity NPC113044
0.9703 High Similarity NPC94272
0.9619 High Similarity NPC167183
0.9619 High Similarity NPC477808
0.9619 High Similarity NPC477810
0.9619 High Similarity NPC32707
0.9615 High Similarity NPC308140
0.9615 High Similarity NPC42171
0.9612 High Similarity NPC247037
0.9604 High Similarity NPC181845
0.9528 High Similarity NPC477029
0.9528 High Similarity NPC477030
0.9515 High Similarity NPC306131
0.9515 High Similarity NPC477026
0.9515 High Similarity NPC475670
0.9515 High Similarity NPC40440
0.9515 High Similarity NPC42482
0.9515 High Similarity NPC477027
0.9515 High Similarity NPC70204
0.9439 High Similarity NPC477807
0.9434 High Similarity NPC11548
0.9434 High Similarity NPC208832
0.9429 High Similarity NPC254255
0.9423 High Similarity NPC141433
0.9417 High Similarity NPC476538
0.9417 High Similarity NPC476541
0.9417 High Similarity NPC476539
0.9417 High Similarity NPC476540
0.9346 High Similarity NPC63609
0.9346 High Similarity NPC477031
0.934 High Similarity NPC476546
0.9333 High Similarity NPC197231
0.9327 High Similarity NPC302057
0.9245 High Similarity NPC19888
0.9245 High Similarity NPC112274
0.9223 High Similarity NPC309448
0.9223 High Similarity NPC242748
0.9223 High Similarity NPC473923
0.9223 High Similarity NPC474569
0.9223 High Similarity NPC473476
0.9182 High Similarity NPC198325
0.9182 High Similarity NPC233391
0.9182 High Similarity NPC207243
0.9159 High Similarity NPC469347
0.9159 High Similarity NPC469348
0.9159 High Similarity NPC51154
0.9159 High Similarity NPC307642
0.9159 High Similarity NPC476693
0.9159 High Similarity NPC476671
0.9151 High Similarity NPC13190
0.9151 High Similarity NPC470748
0.9135 High Similarity NPC190395
0.9135 High Similarity NPC226642
0.9118 High Similarity NPC272015
0.9091 High Similarity NPC195560
0.9091 High Similarity NPC229962
0.9083 High Similarity NPC20979
0.9048 High Similarity NPC159005
0.9048 High Similarity NPC295980
0.9048 High Similarity NPC6931
0.9048 High Similarity NPC220427
0.9038 High Similarity NPC26798
0.9018 High Similarity NPC305771
0.9018 High Similarity NPC169816
0.9018 High Similarity NPC15918
0.9018 High Similarity NPC94072
0.9009 High Similarity NPC50689
0.9 High Similarity NPC475357
0.8991 High Similarity NPC148965
0.8972 High Similarity NPC92710
0.8962 High Similarity NPC476835
0.8952 High Similarity NPC63368
0.8952 High Similarity NPC473469
0.8952 High Similarity NPC14946
0.8952 High Similarity NPC208650
0.8942 High Similarity NPC187400
0.8942 High Similarity NPC221562
0.8942 High Similarity NPC470885
0.8938 High Similarity NPC256983
0.8938 High Similarity NPC202261
0.8938 High Similarity NPC106589
0.8929 High Similarity NPC249553
0.8929 High Similarity NPC476544
0.8929 High Similarity NPC182900
0.8929 High Similarity NPC476543
0.8929 High Similarity NPC476545
0.8922 High Similarity NPC282669
0.8919 High Similarity NPC476085
0.8919 High Similarity NPC473633
0.8911 High Similarity NPC243728
0.8911 High Similarity NPC473890
0.8879 High Similarity NPC470867
0.8868 High Similarity NPC49032
0.8868 High Similarity NPC246124
0.8868 High Similarity NPC128123
0.8868 High Similarity NPC180183
0.8868 High Similarity NPC7213
0.8868 High Similarity NPC125324
0.8868 High Similarity NPC51172
0.8857 High Similarity NPC269627
0.8857 High Similarity NPC208477
0.8857 High Similarity NPC127801
0.8857 High Similarity NPC69737
0.8857 High Similarity NPC208594
0.8857 High Similarity NPC194842
0.8857 High Similarity NPC152584
0.8857 High Similarity NPC160816
0.885 High Similarity NPC43842
0.8839 High Similarity NPC475358
0.8839 High Similarity NPC473566
0.8829 High Similarity NPC476691
0.8829 High Similarity NPC475403
0.8829 High Similarity NPC160888
0.8829 High Similarity NPC10366
0.8829 High Similarity NPC476692
0.8824 High Similarity NPC158088
0.8807 High Similarity NPC144068
0.8796 High Similarity NPC114188
0.8785 High Similarity NPC14630
0.8785 High Similarity NPC250089
0.8785 High Similarity NPC151134
0.8785 High Similarity NPC157530
0.8774 High Similarity NPC181467
0.8772 High Similarity NPC295133
0.8772 High Similarity NPC257207
0.8762 High Similarity NPC475365
0.875 High Similarity NPC161738
0.875 High Similarity NPC312553
0.875 High Similarity NPC288694
0.875 High Similarity NPC159036
0.8739 High Similarity NPC100048
0.8739 High Similarity NPC476690
0.8696 High Similarity NPC473505
0.8679 High Similarity NPC470512
0.8679 High Similarity NPC173859
0.8673 High Similarity NPC476670
0.8667 High Similarity NPC157659
0.8667 High Similarity NPC245280
0.8667 High Similarity NPC16573
0.8667 High Similarity NPC473020
0.8667 High Similarity NPC189852
0.8667 High Similarity NPC16520
0.8667 High Similarity NPC213190
0.8667 High Similarity NPC475701
0.8667 High Similarity NPC114874
0.8667 High Similarity NPC286969
0.8667 High Similarity NPC131479
0.8667 High Similarity NPC120123
0.8667 High Similarity NPC123796
0.8667 High Similarity NPC31907
0.8667 High Similarity NPC155010
0.8667 High Similarity NPC472252

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC269297 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
0.819 Intermediate Similarity NPD8377 Approved
0.819 Intermediate Similarity NPD8294 Approved
0.8155 Intermediate Similarity NPD8171 Discontinued
0.813 Intermediate Similarity NPD8450 Suspended
0.812 Intermediate Similarity NPD8335 Approved
0.812 Intermediate Similarity NPD8296 Approved
0.812 Intermediate Similarity NPD8378 Approved
0.812 Intermediate Similarity NPD8033 Approved
0.812 Intermediate Similarity NPD8379 Approved
0.812 Intermediate Similarity NPD8380 Approved
0.8049 Intermediate Similarity NPD8449 Approved
0.7928 Intermediate Similarity NPD6412 Phase 2
0.7712 Intermediate Similarity NPD7327 Approved
0.7712 Intermediate Similarity NPD7328 Approved
0.7672 Intermediate Similarity NPD8133 Approved
0.7647 Intermediate Similarity NPD7516 Approved
0.7521 Intermediate Similarity NPD7503 Approved
0.7434 Intermediate Similarity NPD8170 Clinical (unspecified phase)
0.728 Intermediate Similarity NPD7507 Approved
0.7179 Intermediate Similarity NPD8132 Clinical (unspecified phase)
0.7177 Intermediate Similarity NPD6370 Approved
0.7165 Intermediate Similarity NPD7736 Approved
0.712 Intermediate Similarity NPD8328 Phase 3
0.7109 Intermediate Similarity NPD7319 Approved
0.7087 Intermediate Similarity NPD8293 Discontinued
0.7049 Intermediate Similarity NPD8295 Clinical (unspecified phase)
0.7016 Intermediate Similarity NPD6054 Approved
0.7016 Intermediate Similarity NPD6059 Approved
0.699 Remote Similarity NPD6928 Phase 2
0.6949 Remote Similarity NPD6686 Approved
0.6931 Remote Similarity NPD3701 Clinical (unspecified phase)
0.6852 Remote Similarity NPD7524 Approved
0.685 Remote Similarity NPD6067 Discontinued
0.6832 Remote Similarity NPD6942 Approved
0.6832 Remote Similarity NPD7339 Approved
0.6825 Remote Similarity NPD8517 Approved
0.6825 Remote Similarity NPD8515 Approved
0.6825 Remote Similarity NPD6015 Approved
0.6825 Remote Similarity NPD8516 Approved
0.6825 Remote Similarity NPD6016 Approved
0.6797 Remote Similarity NPD7492 Approved
0.6777 Remote Similarity NPD8413 Clinical (unspecified phase)
0.6772 Remote Similarity NPD5988 Approved
0.6744 Remote Similarity NPD6616 Approved
0.6729 Remote Similarity NPD7338 Clinical (unspecified phase)
0.6697 Remote Similarity NPD4751 Clinical (unspecified phase)
0.6693 Remote Similarity NPD8513 Phase 3
0.6692 Remote Similarity NPD7078 Approved
0.6667 Remote Similarity NPD7525 Registered
0.6636 Remote Similarity NPD6695 Phase 3
0.6585 Remote Similarity NPD6882 Approved
0.6585 Remote Similarity NPD8297 Approved
0.6571 Remote Similarity NPD7645 Phase 2
0.6549 Remote Similarity NPD6399 Phase 3
0.6545 Remote Similarity NPD7750 Discontinued
0.6515 Remote Similarity NPD6033 Approved
0.6508 Remote Similarity NPD6009 Approved
0.6484 Remote Similarity NPD6319 Approved
0.6442 Remote Similarity NPD6933 Approved
0.6434 Remote Similarity NPD7625 Phase 1
0.6422 Remote Similarity NPD4786 Approved
0.6415 Remote Similarity NPD6929 Approved
0.641 Remote Similarity NPD7638 Approved
0.6408 Remote Similarity NPD4785 Approved
0.6408 Remote Similarity NPD4784 Approved
0.64 Remote Similarity NPD4632 Approved
0.6393 Remote Similarity NPD7320 Approved
0.6373 Remote Similarity NPD4243 Approved
0.6364 Remote Similarity NPD6008 Approved
0.6364 Remote Similarity NPD6675 Approved
0.6364 Remote Similarity NPD7128 Approved
0.6364 Remote Similarity NPD6402 Approved
0.6364 Remote Similarity NPD5739 Approved
0.6356 Remote Similarity NPD7639 Approved
0.6356 Remote Similarity NPD7640 Approved
0.6355 Remote Similarity NPD6931 Approved
0.6355 Remote Similarity NPD6930 Phase 2
0.6341 Remote Similarity NPD6372 Approved
0.6341 Remote Similarity NPD6373 Approved
0.6325 Remote Similarity NPD6084 Phase 2
0.6325 Remote Similarity NPD6083 Phase 2
0.6296 Remote Similarity NPD5956 Approved
0.6293 Remote Similarity NPD7991 Discontinued
0.626 Remote Similarity NPD6881 Approved
0.626 Remote Similarity NPD6899 Approved
0.625 Remote Similarity NPD6924 Approved
0.625 Remote Similarity NPD6926 Approved
0.624 Remote Similarity NPD6649 Approved
0.624 Remote Similarity NPD8130 Phase 1
0.624 Remote Similarity NPD6650 Approved
0.6239 Remote Similarity NPD3667 Approved
0.6226 Remote Similarity NPD6925 Approved
0.6226 Remote Similarity NPD6932 Approved
0.6226 Remote Similarity NPD5776 Phase 2
0.6204 Remote Similarity NPD4748 Discontinued
0.6186 Remote Similarity NPD4755 Approved
0.6179 Remote Similarity NPD5697 Approved
0.6179 Remote Similarity NPD5701 Approved
0.6174 Remote Similarity NPD7087 Discontinued
0.6168 Remote Similarity NPD7145 Approved
0.616 Remote Similarity NPD6883 Approved
0.616 Remote Similarity NPD7290 Approved
0.616 Remote Similarity NPD7102 Approved
0.616 Remote Similarity NPD4634 Approved
0.614 Remote Similarity NPD6051 Approved
0.614 Remote Similarity NPD4753 Phase 2
0.6126 Remote Similarity NPD3665 Phase 1
0.6126 Remote Similarity NPD3133 Approved
0.6126 Remote Similarity NPD3666 Approved
0.6124 Remote Similarity NPD7115 Discovery
0.6121 Remote Similarity NPD4202 Approved
0.6111 Remote Similarity NPD6847 Approved
0.6111 Remote Similarity NPD6869 Approved
0.6111 Remote Similarity NPD6617 Approved
0.6111 Remote Similarity NPD6683 Phase 2
0.609 Remote Similarity NPD7604 Phase 2
0.6083 Remote Similarity NPD4696 Approved
0.6083 Remote Similarity NPD5285 Approved
0.6083 Remote Similarity NPD5286 Approved
0.6083 Remote Similarity NPD4700 Approved
0.608 Remote Similarity NPD6012 Approved
0.608 Remote Similarity NPD6014 Approved
0.608 Remote Similarity NPD6013 Approved
0.6071 Remote Similarity NPD6893 Approved
0.6068 Remote Similarity NPD7748 Approved
0.6063 Remote Similarity NPD6053 Discontinued
0.6061 Remote Similarity NPD5983 Phase 2
0.6058 Remote Similarity NPD7151 Approved
0.6058 Remote Similarity NPD7152 Approved
0.6058 Remote Similarity NPD7150 Approved
0.6055 Remote Similarity NPD7514 Phase 3
0.6053 Remote Similarity NPD7513 Clinical (unspecified phase)
0.6053 Remote Similarity NPD6903 Approved
0.605 Remote Similarity NPD7902 Approved
0.6038 Remote Similarity NPD4190 Phase 3
0.6038 Remote Similarity NPD5275 Approved
0.6034 Remote Similarity NPD8035 Phase 2
0.6034 Remote Similarity NPD7637 Suspended
0.6034 Remote Similarity NPD8034 Phase 2
0.6033 Remote Similarity NPD4159 Approved
0.6029 Remote Similarity NPD8336 Approved
0.6029 Remote Similarity NPD8337 Approved
0.6019 Remote Similarity NPD6923 Approved
0.6019 Remote Similarity NPD6922 Approved
0.6018 Remote Similarity NPD6409 Approved
0.6018 Remote Similarity NPD7521 Approved
0.6018 Remote Similarity NPD7334 Approved
0.6018 Remote Similarity NPD6684 Approved
0.6018 Remote Similarity NPD7146 Approved
0.6018 Remote Similarity NPD5330 Approved
0.6017 Remote Similarity NPD5695 Phase 3
0.6 Remote Similarity NPD5696 Approved
0.6 Remote Similarity NPD5328 Approved
0.6 Remote Similarity NPD6011 Approved
0.6 Remote Similarity NPD6336 Discontinued
0.6 Remote Similarity NPD4225 Approved
0.6 Remote Similarity NPD6902 Approved
0.5984 Remote Similarity NPD6401 Clinical (unspecified phase)
0.5984 Remote Similarity NPD5211 Phase 2
0.5984 Remote Similarity NPD4633 Approved
0.5984 Remote Similarity NPD5224 Approved
0.5984 Remote Similarity NPD5225 Approved
0.5984 Remote Similarity NPD5226 Approved
0.5968 Remote Similarity NPD4767 Approved
0.5968 Remote Similarity NPD4768 Approved
0.5963 Remote Similarity NPD4195 Approved
0.5962 Remote Similarity NPD7143 Approved
0.5962 Remote Similarity NPD7144 Approved
0.5935 Remote Similarity NPD5174 Approved
0.5935 Remote Similarity NPD5175 Approved
0.5909 Remote Similarity NPD7509 Discontinued
0.5909 Remote Similarity NPD7332 Phase 2
0.5902 Remote Similarity NPD5223 Approved
0.5897 Remote Similarity NPD7515 Phase 2
0.5897 Remote Similarity NPD6079 Approved
0.5887 Remote Similarity NPD5141 Approved
0.5882 Remote Similarity NPD5210 Approved
0.5882 Remote Similarity NPD4629 Approved
0.5882 Remote Similarity NPD6356 Clinical (unspecified phase)
0.5877 Remote Similarity NPD3618 Phase 1
0.5873 Remote Similarity NPD4730 Approved
0.5873 Remote Similarity NPD4729 Approved
0.5868 Remote Similarity NPD8029 Clinical (unspecified phase)
0.5856 Remote Similarity NPD6898 Phase 1
0.5854 Remote Similarity NPD7632 Discontinued
0.5841 Remote Similarity NPD3668 Phase 3
0.5839 Remote Similarity NPD8074 Phase 3
0.5827 Remote Similarity NPD4061 Clinical (unspecified phase)
0.5826 Remote Similarity NPD4250 Approved
0.5826 Remote Similarity NPD4251 Approved
0.5812 Remote Similarity NPD3168 Discontinued
0.5806 Remote Similarity NPD4754 Approved
0.5804 Remote Similarity NPD4221 Approved
0.5804 Remote Similarity NPD4223 Phase 3
0.5802 Remote Similarity NPD6274 Approved
0.5798 Remote Similarity NPD7901 Clinical (unspecified phase)
0.5798 Remote Similarity NPD7900 Approved
0.5794 Remote Similarity NPD1811 Approved
0.5794 Remote Similarity NPD1810 Approved
0.5794 Remote Similarity NPD7899 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   328441
ChEMBL   CHEMBL2004307
ZINC  

Physicochemical Properties

Molecular Weight:  1014.54
ALogP:  -5.2105
MLogP:  4.87
XLogP:  2.002
# Rotatable Bonds:  26
Polar Surface Area:  294.6
# H-Bond Aceptor:  20
# H-Bond Donor:  10
# Rings:  10
# Heavy Atoms:  71

Download Data

Data Type Select
General Info & Identifiers & Properties  
Structure MOL file  
Source Organisms  
Biological Activities  
Similar NPs/Drugs