Natural Product: NPC211187

Natural Product ID:  NPC211187
Common Name:   (5-Hydroxy-4,6-Dimethylpyridin-3-Yl)Methyl Dihydrogen Phosphate
IUPAC Name:   (5-hydroxy-4,6-dimethylpyridin-3-yl)methyl dihydrogen phosphate
Synonyms:  
Molecular Formula:   C8H12NO5P
Standard InCHIKey:  RBCOYOYDYNXAFA-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C8H12NO5P/c1-5-7(4-14-15(11,12)13)3-9-6(2)8(5)10/h3,10H,4H2,1-2H3,(H2,11,12,13)
Canonical SMILES:  Cc1c(COP(=O)(O)O)cnc(c1O)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
NPO29653 Hippophae fructus Species Elaeagnaceae Eukaryota TCMSP*

  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 100000 nM PubChem BioAssay data set
NPT368 Cell Line SN12C Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT369 Cell Line ACHN Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT370 Cell Line NCI-H23 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT371 Cell Line UO-31 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT372 Cell Line HOP-92 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT116 Cell Line HL-60 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT373 Cell Line SK-MEL-5 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT375 Cell Line Malme-3M Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT111 Cell Line K562 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT376 Cell Line A498 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT377 Cell Line OVCAR-3 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT112 Cell Line MOLT-4 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT379 Cell Line HOP-62 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT378 Cell Line NCI/ADR-RES Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT380 Cell Line U-251 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT381 Cell Line OVCAR-8 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT382 Cell Line OVCAR-5 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT82 Cell Line MDA-MB-231 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT383 Cell Line SNB-19 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT385 Cell Line SR Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT384 Cell Line TK-10 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT323 Cell Line SW-620 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT455 Cell Line NCI-H522 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT386 Cell Line KM12 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT388 Cell Line NCI-H322M Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT387 Cell Line M14 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT456 Cell Line OVCAR-4 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT390 Cell Line LOX IMVI Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT457 Cell Line BT-549 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT147 Cell Line SK-MEL-2 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT81 Cell Line A549 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT148 Cell Line HCT-15 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT393 Cell Line HCT-116 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT395 Cell Line SF-268 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT394 Cell Line EKVX Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT306 Cell Line PC-3 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT396 Cell Line T47D Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT397 Cell Line NCI-H460 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT308 Cell Line CAKI-1 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT398 Cell Line UACC-62 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT399 Cell Line SF-295 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT400 Cell Line MDA-MB-435 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT458 Cell Line IGROV-1 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT402 Cell Line Hs-578T Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT401 Cell Line 786-0 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT403 Cell Line UACC-257 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT139 Cell Line HT-29 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT405 Cell Line NCI-H226 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT170 Cell Line SK-MEL-28 Homo sapiens GI50 100000 nM PubChem BioAssay data set
NPT406 Cell Line RXF 393 Homo sapiens GI50 100000 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 NPC211187 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
0.9739 High Similarity NPC256828
0.9467 High Similarity NPC63562
0.9342 High Similarity NPC132680
0.9342 High Similarity NPC269919
0.9221 High Similarity NPC63338
0.9221 High Similarity NPC322976
0.9221 High Similarity NPC324203
0.9103 High Similarity NPC263439
0.8976 High Similarity NPC36498
0.8503 High Similarity NPC52831
0.8503 High Similarity NPC325705
0.7987 Intermediate Similarity NPC220523
0.7683 Intermediate Similarity NPC153769
0.7616 Intermediate Similarity NPC252590
0.7611 Intermediate Similarity NPC3715
0.7558 Intermediate Similarity NPC314940
0.7558 Intermediate Similarity NPC473764
0.75 Intermediate Similarity NPC174421
0.7453 Intermediate Similarity NPC318935
0.7439 Intermediate Similarity NPC161292
0.7438 Intermediate Similarity NPC471596
0.7423 Intermediate Similarity NPC471598
0.7399 Intermediate Similarity NPC319456
0.7391 Intermediate Similarity NPC280853
0.7362 Intermediate Similarity NPC470403
0.7362 Intermediate Similarity NPC470404
0.7362 Intermediate Similarity NPC470394
0.7346 Intermediate Similarity NPC285016
0.7346 Intermediate Similarity NPC245657
0.7326 Intermediate Similarity NPC473057
0.7325 Intermediate Similarity NPC315320
0.7283 Intermediate Similarity NPC471178
0.7273 Intermediate Similarity NPC470395
0.7244 Intermediate Similarity NPC165370
0.7244 Intermediate Similarity NPC212125
0.7241 Intermediate Similarity NPC108469
0.7222 Intermediate Similarity NPC471594
0.7204 Intermediate Similarity NPC106937
0.7191 Intermediate Similarity NPC194724
0.711 Intermediate Similarity NPC25899
0.7105 Intermediate Similarity NPC476167
0.7102 Intermediate Similarity NPC44161
0.7099 Intermediate Similarity NPC29702
0.7099 Intermediate Similarity NPC328029
0.7093 Intermediate Similarity NPC138018
0.7093 Intermediate Similarity NPC116573
0.7085 Intermediate Similarity NPC477110
0.7072 Intermediate Similarity NPC478032
0.7069 Intermediate Similarity NPC124542
0.7069 Intermediate Similarity NPC471177
0.7069 Intermediate Similarity NPC59779
0.7059 Intermediate Similarity NPC284348
0.7053 Intermediate Similarity NPC192315
0.7033 Intermediate Similarity NPC219963
0.7029 Intermediate Similarity NPC97367
0.7027 Intermediate Similarity NPC46580
0.7026 Intermediate Similarity NPC316403
0.7025 Intermediate Similarity NPC306397
0.7022 Intermediate Similarity NPC253810
0.7011 Intermediate Similarity NPC314002
0.7006 Intermediate Similarity NPC151489
0.7 Intermediate Similarity NPC224928
0.6982 Remote Similarity NPC257142
0.6971 Remote Similarity NPC48192
0.6961 Remote Similarity NPC96890
0.6957 Remote Similarity NPC207851
0.6957 Remote Similarity NPC204717
0.6954 Remote Similarity NPC84508
0.694 Remote Similarity NPC161887
0.694 Remote Similarity NPC266551
0.6927 Remote Similarity NPC273532
0.6923 Remote Similarity NPC42979
0.6919 Remote Similarity NPC5145
0.6915 Remote Similarity NPC470799
0.6915 Remote Similarity NPC8022
0.6907 Remote Similarity NPC470678
0.6906 Remote Similarity NPC224764
0.6905 Remote Similarity NPC471323
0.6904 Remote Similarity NPC477111
0.6904 Remote Similarity NPC18348
0.6902 Remote Similarity NPC220765
0.6882 Remote Similarity NPC171171
0.6881 Remote Similarity NPC473513
0.6868 Remote Similarity NPC184964
0.6865 Remote Similarity NPC284559
0.6865 Remote Similarity NPC320394
0.6854 Remote Similarity NPC41717
0.6852 Remote Similarity NPC256893
0.6847 Remote Similarity NPC314270
0.6842 Remote Similarity NPC226202
0.6842 Remote Similarity NPC329541
0.6828 Remote Similarity NPC42591
0.6828 Remote Similarity NPC295158
0.6823 Remote Similarity NPC267928
0.6814 Remote Similarity NPC315804
0.6814 Remote Similarity NPC313804
0.6813 Remote Similarity NPC150048
0.6813 Remote Similarity NPC203754
0.6802 Remote Similarity NPC477113
0.6791 Remote Similarity NPC314573
0.6789 Remote Similarity NPC195268
0.6789 Remote Similarity NPC133140
0.6786 Remote Similarity NPC60553
0.678 Remote Similarity NPC79911
0.6771 Remote Similarity NPC251090
0.6765 Remote Similarity NPC173080
0.6751 Remote Similarity NPC472259
0.6751 Remote Similarity NPC470500
0.6742 Remote Similarity NPC102423
0.674 Remote Similarity NPC158129
0.674 Remote Similarity NPC249614
0.674 Remote Similarity NPC302647
0.6738 Remote Similarity NPC62510
0.6738 Remote Similarity NPC241025
0.6737 Remote Similarity NPC114974
0.6736 Remote Similarity NPC156704
0.6723 Remote Similarity NPC120798
0.672 Remote Similarity NPC32771
0.672 Remote Similarity NPC75544
0.6702 Remote Similarity NPC99666
0.6701 Remote Similarity NPC200836
0.6701 Remote Similarity NPC475774
0.6685 Remote Similarity NPC71079
0.6685 Remote Similarity NPC177404
0.6684 Remote Similarity NPC242209
0.6683 Remote Similarity NPC112206
0.6683 Remote Similarity NPC202605
0.6667 Remote Similarity NPC244536
0.6667 Remote Similarity NPC289786
0.6667 Remote Similarity NPC274291
0.6667 Remote Similarity NPC113812
0.6667 Remote Similarity NPC470474
0.6667 Remote Similarity NPC47059
0.6667 Remote Similarity NPC329708
0.6667 Remote Similarity NPC118832
0.6667 Remote Similarity NPC165349
0.6667 Remote Similarity NPC264166
0.665 Remote Similarity NPC211813
0.6649 Remote Similarity NPC20249
0.6648 Remote Similarity NPC474217
0.6633 Remote Similarity NPC19872
0.6632 Remote Similarity NPC326634
0.6632 Remote Similarity NPC472289
0.6631 Remote Similarity NPC48938
0.6629 Remote Similarity NPC131718
0.6617 Remote Similarity NPC185782
0.6616 Remote Similarity NPC53144
0.6615 Remote Similarity NPC472284
0.6612 Remote Similarity NPC471294
0.6612 Remote Similarity NPC313791
0.6611 Remote Similarity NPC85918
0.661 Remote Similarity NPC212742
0.6601 Remote Similarity NPC26679
0.66 Remote Similarity NPC88008
0.6599 Remote Similarity NPC155792
0.6598 Remote Similarity NPC473053
0.6596 Remote Similarity NPC62069
0.6595 Remote Similarity NPC283152
0.6593 Remote Similarity NPC126481
0.6591 Remote Similarity NPC263455
0.6583 Remote Similarity NPC475070
0.6582 Remote Similarity NPC4071
0.6582 Remote Similarity NPC476582
0.6582 Remote Similarity NPC476578
0.658 Remote Similarity NPC307963
0.6576 Remote Similarity NPC95898
0.6575 Remote Similarity NPC278366
0.6575 Remote Similarity NPC127730
0.6573 Remote Similarity NPC230869
0.6564 Remote Similarity NPC77555
0.6564 Remote Similarity NPC90229
0.6559 Remote Similarity NPC164340
0.6557 Remote Similarity NPC121658
0.6557 Remote Similarity NPC14651
0.6556 Remote Similarity NPC78375
0.6556 Remote Similarity NPC476446
0.6556 Remote Similarity NPC469813
0.6548 Remote Similarity NPC315491
0.6548 Remote Similarity NPC213308
0.6548 Remote Similarity NPC45459
0.6546 Remote Similarity NPC146724
0.6545 Remote Similarity NPC324611
0.6545 Remote Similarity NPC110741
0.6545 Remote Similarity NPC230805
0.6545 Remote Similarity NPC44354
0.6541 Remote Similarity NPC134586
0.6533 Remote Similarity NPC245816
0.6533 Remote Similarity NPC476138
0.6532 Remote Similarity NPC302159
0.6528 Remote Similarity NPC324149
0.6528 Remote Similarity NPC56170
0.6524 Remote Similarity NPC317010
0.6522 Remote Similarity NPC259545
0.6522 Remote Similarity NPC473822
0.6517 Remote Similarity NPC475870
0.6515 Remote Similarity NPC31930
0.6513 Remote Similarity NPC109922
0.6506 Remote Similarity NPC322488
0.6505 Remote Similarity NPC142901
0.6505 Remote Similarity NPC211997

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC211187 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
0.9342 High Similarity NPD9382 Approved
0.9342 High Similarity NPD9383 Approved
0.9221 High Similarity NPD9398 Clinical (unspecified phase)
0.8976 High Similarity NPD9363 Approved
0.8976 High Similarity NPD9364 Phase 2
0.8765 High Similarity NPD5317 Clinical (unspecified phase)
0.8675 High Similarity NPD9362 Approved
0.8503 High Similarity NPD9510 Approved
0.8253 Intermediate Similarity NPD2123 Phase 3
0.7845 Intermediate Similarity NPD1229 Phase 2
0.7809 Intermediate Similarity NPD5316 Approved
0.7791 Intermediate Similarity NPD9706 Clinical (unspecified phase)
0.756 Intermediate Similarity NPD604 Clinical (unspecified phase)
0.7429 Intermediate Similarity NPD9690 Approved
0.7384 Intermediate Similarity NPD925 Approved
0.7384 Intermediate Similarity NPD926 Approved
0.7375 Intermediate Similarity NPD9506 Approved
0.7325 Intermediate Similarity NPD9206 Approved
0.7325 Intermediate Similarity NPD9207 Approved
0.7322 Intermediate Similarity NPD1213 Phase 3
0.7251 Intermediate Similarity NPD5255 Approved
0.7247 Intermediate Similarity NPD5751 Clinical (unspecified phase)
0.7244 Intermediate Similarity NPD9284 Approved
0.7241 Intermediate Similarity NPD425 Approved
0.7241 Intermediate Similarity NPD424 Approved
0.7209 Intermediate Similarity NPD112 Approved
0.7209 Intermediate Similarity NPD9705 Discontinued
0.7204 Intermediate Similarity NPD802 Phase 2
0.7135 Intermediate Similarity NPD158 Discontinued
0.7126 Intermediate Similarity NPD862 Approved
0.7126 Intermediate Similarity NPD861 Approved
0.7126 Intermediate Similarity NPD863 Approved
0.7108 Intermediate Similarity NPD1352 Discontinued
0.7056 Intermediate Similarity NPD6159 Phase 2
0.703 Intermediate Similarity NPD1649 Discontinued
0.7025 Intermediate Similarity NPD9080 Approved
0.7021 Intermediate Similarity NPD9695 Approved
0.7012 Intermediate Similarity NPD203 Clinical (unspecified phase)
0.7006 Intermediate Similarity NPD2781 Approved
0.7 Intermediate Similarity NPD1622 Discontinued
0.6994 Remote Similarity NPD2582 Approved
0.6994 Remote Similarity NPD2581 Approved
0.6989 Remote Similarity NPD2782 Approved
0.6989 Remote Similarity NPD2780 Approved
0.6973 Remote Similarity NPD5256 Discontinued
0.6952 Remote Similarity NPD2544 Clinical (unspecified phase)
0.6935 Remote Similarity NPD1033 Clinical (unspecified phase)
0.6935 Remote Similarity NPD1034 Phase 3
0.6914 Remote Similarity NPD1418 Phase 2
0.691 Remote Similarity NPD6872 Clinical (unspecified phase)
0.6909 Remote Similarity NPD9076 Clinical (unspecified phase)
0.6905 Remote Similarity NPD3813 Approved
0.6878 Remote Similarity NPD9689 Approved
0.6878 Remote Similarity NPD6569 Phase 2
0.6872 Remote Similarity NPD565 Phase 2
0.6839 Remote Similarity NPD2175 Phase 3
0.6839 Remote Similarity NPD2176 Approved
0.6839 Remote Similarity NPD2177 Approved
0.6814 Remote Similarity NPD537 Phase 2
0.6814 Remote Similarity NPD534 Phase 2
0.6813 Remote Similarity NPD5100 Phase 3
0.6789 Remote Similarity NPD3923 Approved
0.6789 Remote Similarity NPD3922 Approved
0.6789 Remote Similarity NPD3921 Approved
0.6789 Remote Similarity NPD3924 Approved
0.6784 Remote Similarity NPD4703 Approved
0.6784 Remote Similarity NPD4702 Approved
0.6774 Remote Similarity NPD1096 Discontinued
0.6772 Remote Similarity NPD8063 Discontinued
0.6757 Remote Similarity NPD1783 Clinical (unspecified phase)
0.6755 Remote Similarity NPD2383 Phase 1
0.6746 Remote Similarity NPD3525 Discontinued
0.6736 Remote Similarity NPD2952 Discontinued
0.6723 Remote Similarity NPD687 Clinical (unspecified phase)
0.6716 Remote Similarity NPD4131 Phase 3
0.6705 Remote Similarity NPD4671 Clinical (unspecified phase)
0.6705 Remote Similarity NPD4669 Clinical (unspecified phase)
0.6705 Remote Similarity NPD4670 Clinical (unspecified phase)
0.6684 Remote Similarity NPD3321 Discontinued
0.6684 Remote Similarity NPD3478 Clinical (unspecified phase)
0.6684 Remote Similarity NPD3477 Phase 2
0.6683 Remote Similarity NPD796 Phase 2
0.6667 Remote Similarity NPD4036 Approved
0.6667 Remote Similarity NPD4033 Approved
0.6667 Remote Similarity NPD4122 Approved
0.6667 Remote Similarity NPD4035 Approved
0.6667 Remote Similarity NPD9687 Approved
0.6667 Remote Similarity NPD7414 Clinical (unspecified phase)
0.6667 Remote Similarity NPD4086 Phase 1
0.6667 Remote Similarity NPD4034 Approved
0.6667 Remote Similarity NPD4038 Approved
0.6667 Remote Similarity NPD4039 Approved
0.6667 Remote Similarity NPD32 Approved
0.6667 Remote Similarity NPD4037 Approved
0.6667 Remote Similarity NPD31 Approved
0.6667 Remote Similarity NPD4203 Approved
0.6667 Remote Similarity NPD9688 Approved
0.6667 Remote Similarity NPD4204 Approved
0.6649 Remote Similarity NPD8036 Clinical (unspecified phase)
0.6649 Remote Similarity NPD8037 Clinical (unspecified phase)
0.6649 Remote Similarity NPD7948 Phase 1
0.6649 Remote Similarity NPD1620 Clinical (unspecified phase)
0.6648 Remote Similarity NPD485 Clinical (unspecified phase)
0.6648 Remote Similarity NPD1078 Clinical (unspecified phase)
0.6647 Remote Similarity NPD3717 Discontinued
0.6634 Remote Similarity NPD3779 Clinical (unspecified phase)
0.6633 Remote Similarity NPD4396 Clinical (unspecified phase)
0.6632 Remote Similarity NPD3395 Approved
0.6632 Remote Similarity NPD4021 Phase 2
0.6632 Remote Similarity NPD3396 Approved
0.6614 Remote Similarity NPD3039 Clinical (unspecified phase)
0.6608 Remote Similarity NPD8823 Approved
0.66 Remote Similarity NPD6290 Phase 2
0.658 Remote Similarity NPD1038 Approved
0.658 Remote Similarity NPD5575 Clinical (unspecified phase)
0.658 Remote Similarity NPD4551 Phase 2
0.6571 Remote Similarity NPD9595 Approved
0.6571 Remote Similarity NPD9596 Approved
0.6562 Remote Similarity NPD4699 Discontinued
0.6561 Remote Similarity NPD3082 Discontinued
0.6561 Remote Similarity NPD4889 Approved
0.6561 Remote Similarity NPD6344 Clinical (unspecified phase)
0.6556 Remote Similarity NPD8129 Discovery
0.6555 Remote Similarity NPD8356 Approved
0.6552 Remote Similarity NPD4502 Phase 2
0.6548 Remote Similarity NPD484 Approved
0.6545 Remote Similarity NPD9714 Clinical (unspecified phase)
0.6538 Remote Similarity NPD5862 Discovery
0.6531 Remote Similarity NPD7889 Clinical (unspecified phase)
0.6522 Remote Similarity NPD2076 Approved
0.6522 Remote Similarity NPD2077 Approved
0.6517 Remote Similarity NPD1392 Approved
0.6517 Remote Similarity NPD9574 Clinical (unspecified phase)
0.6509 Remote Similarity NPD6553 Clinical (unspecified phase)
0.6505 Remote Similarity NPD1032 Phase 2
0.65 Remote Similarity NPD1685 Approved
0.65 Remote Similarity NPD1684 Approved
0.6489 Remote Similarity NPD1570 Approved
0.6488 Remote Similarity NPD2616 Phase 3
0.6488 Remote Similarity NPD2615 Phase 3
0.648 Remote Similarity NPD704 Clinical (unspecified phase)
0.6476 Remote Similarity NPD4945 Discontinued
0.6474 Remote Similarity NPD9075 Approved
0.6474 Remote Similarity NPD9074 Approved
0.6471 Remote Similarity NPD5936 Approved
0.6471 Remote Similarity NPD5939 Approved
0.6471 Remote Similarity NPD3570 Phase 2
0.6468 Remote Similarity NPD2414 Clinical (unspecified phase)
0.6468 Remote Similarity NPD3932 Clinical (unspecified phase)
0.6465 Remote Similarity NPD6389 Clinical (unspecified phase)
0.6462 Remote Similarity NPD5640 Discontinued
0.6462 Remote Similarity NPD7603 Discontinued
0.6461 Remote Similarity NPD1274 Clinical (unspecified phase)
0.6457 Remote Similarity NPD3575 Approved
0.6457 Remote Similarity NPD3576 Approved
0.6443 Remote Similarity NPD4372 Phase 1
0.644 Remote Similarity NPD4375 Approved
0.6436 Remote Similarity NPD7222 Phase 2
0.6436 Remote Similarity NPD3930 Clinical (unspecified phase)
0.6432 Remote Similarity NPD8430 Approved
0.6425 Remote Similarity NPD5612 Discontinued
0.6421 Remote Similarity NPD5083 Clinical (unspecified phase)
0.6417 Remote Similarity NPD4072 Approved
0.6417 Remote Similarity NPD4071 Approved
0.6414 Remote Similarity NPD5999 Phase 2
0.6411 Remote Similarity NPD7203 Clinical (unspecified phase)
0.641 Remote Similarity NPD4526 Approved
0.641 Remote Similarity NPD4528 Approved
0.641 Remote Similarity NPD4529 Approved
0.6402 Remote Similarity NPD3386 Phase 2
0.64 Remote Similarity NPD3928 Approved
0.64 Remote Similarity NPD3931 Approved
0.6398 Remote Similarity NPD1923 Clinical (unspecified phase)
0.6392 Remote Similarity NPD4148 Approved
0.6387 Remote Similarity NPD6227 Discontinued
0.6383 Remote Similarity NPD1503 Clinical (unspecified phase)
0.6382 Remote Similarity NPD1739 Approved
0.6382 Remote Similarity NPD1740 Approved
0.6374 Remote Similarity NPD5088 Discontinued
0.6373 Remote Similarity NPD4437 Phase 3
0.6369 Remote Similarity NPD276 Clinical (unspecified phase)
0.6368 Remote Similarity NPD5596 Phase 2
0.6364 Remote Similarity NPD8109 Clinical (unspecified phase)
0.6364 Remote Similarity NPD5352 Clinical (unspecified phase)
0.6359 Remote Similarity NPD3330 Phase 1
0.6354 Remote Similarity NPD706 Phase 1
0.6349 Remote Similarity NPD2601 Approved
0.6349 Remote Similarity NPD2600 Approved
0.6349 Remote Similarity NPD2599 Approved
0.634 Remote Similarity NPD4081 Clinical (unspecified phase)
0.6337 Remote Similarity NPD4795 Phase 2
0.6327 Remote Similarity NPD1304 Clinical (unspecified phase)
0.6327 Remote Similarity NPD6361 Phase 2
0.6324 Remote Similarity NPD5320 Approved
0.6324 Remote Similarity NPD5319 Approved
0.6324 Remote Similarity NPD4724 Clinical (unspecified phase)
0.6322 Remote Similarity NPD751 Clinical (unspecified phase)
0.6321 Remote Similarity NPD1856 Discontinued
0.6321 Remote Similarity NPD8020 Approved
0.6321 Remote Similarity NPD8021 Approved

Structure

External Identifiers

PubChem CID   95687
ChEMBL   CHEMBL1235333
ZINC  

Physicochemical Properties

Molecular Weight:  233.05
ALogP:  0.2367
MLogP:  1.57
XLogP:  -1.203
# Rotatable Bonds:  8
Polar Surface Area:  109.69
# H-Bond Aceptor:  5
# H-Bond Donor:  3
# Rings:  1
# Heavy Atoms:  15

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