Natural Product: NPC261292

Natural Product ID:  NPC261292
Common Name:   Hydrangenol
IUPAC Name:   8-hydroxy-3-(4-hydroxyphenyl)-3,4-dihydroisochromen-1-one
Synonyms:   hydrangenol
Molecular Formula:   C15H12O4
Standard InCHIKey:  DGKDFNDHPXVXHW-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C15H12O4/c16-11-6-4-9(5-7-11)13-8-10-2-1-3-12(17)14(10)15(18)19-13/h1-7,13,16-17H,8H2
Canonical SMILES:  Oc1ccc(cc1)C1OC(=O)c2c(C1)cccc2O
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
NPO33513 hydrangeae dulcis folium Species NA NA PMID[9871657]
NPO9360.1 Hydrangea macrophylla var. thunbergii Varieties Hydrangeaceae Eukaryota Leaves PMID[17609121]
NPO9360 Hydrangea macrophylla Species Hydrangeaceae Eukaryota TCM_Taiwan*
NPO9360 Hydrangea macrophylla Species Hydrangeaceae Eukaryota TM-MC*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 14.4 % 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 17.7 % 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 29.9 % 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 41.3 % 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 22.3 ug/ml 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 22.8 ug/ml 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 27.4 ug/ml 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 0.033 ug/ml 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 68.2 ug/ml 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 84.2 ug/ml 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 0.094 ug/ml 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 99.8 ug/ml 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Ratio = 1.98 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Ratio = 2.46 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Ratio = 1.92 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Ratio = 2.65 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Ratio = 0.78 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Ratio = 0.51 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Ratio = 1.12 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Ratio = 1.38 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 117 % 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 160 % 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 221 % 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 245 % 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 302 % 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 336.3 mg/dl 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 336 mg/dl 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 389.1 mg/dl 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 397.5 mg/dl 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 422.7 mg/dl 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 411.2 mg/dl 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 332.1 mg/dl 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 362.8 mg/dl 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 429.3 mg/dl 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 413.8 mg/dl 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 483.9 mg/dl 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 428.8 mg/dl 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 0.96 mEq/L 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 1.01 mEq/L 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 0.91 mEq/L 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 0.81 mEq/L 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 1.07 mEq/L 17609121
NPT32 Organism Mus musculus Mus musculus Activity = 0.89 mEq/L 17609121
NPT520 Cell Line 3T3-L1 Mus musculus Activity = 19.2 % 17609121

  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 NPC261292 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 NPC301915
0.9774 High Similarity NPC155205
0.9474 High Similarity NPC291454
0.9398 High Similarity NPC142027
0.9398 High Similarity NPC27407
0.9389 High Similarity NPC214702
0.9389 High Similarity NPC470831
0.9333 High Similarity NPC472602
0.9333 High Similarity NPC221104
0.9328 High Similarity NPC235115
0.9286 High Similarity NPC476463
0.927 High Similarity NPC53649
0.927 High Similarity NPC470842
0.9124 High Similarity NPC88269
0.9118 High Similarity NPC70380
0.9104 High Similarity NPC153783
0.9071 High Similarity NPC42540
0.9071 High Similarity NPC151607
0.9058 High Similarity NPC472601
0.9058 High Similarity NPC472600
0.9051 High Similarity NPC33144
0.9051 High Similarity NPC197666
0.9051 High Similarity NPC191835
0.9051 High Similarity NPC126739
0.9051 High Similarity NPC94248
0.9051 High Similarity NPC212693
0.9051 High Similarity NPC478200
0.9 High Similarity NPC469542
0.9 High Similarity NPC159721
0.9 High Similarity NPC478202
0.8993 High Similarity NPC472603
0.8993 High Similarity NPC313123
0.8993 High Similarity NPC472605
0.8993 High Similarity NPC472604
0.8993 High Similarity NPC478217
0.8993 High Similarity NPC158634
0.8986 High Similarity NPC268052
0.8986 High Similarity NPC139634
0.8986 High Similarity NPC32360
0.8986 High Similarity NPC105456
0.8978 High Similarity NPC71256
0.8966 High Similarity NPC295646
0.8955 High Similarity NPC219892
0.8955 High Similarity NPC189823
0.8951 High Similarity NPC221352
0.8944 High Similarity NPC267509
0.8929 High Similarity NPC250755
0.8929 High Similarity NPC471733
0.8921 High Similarity NPC168471
0.8921 High Similarity NPC158472
0.8897 High Similarity NPC175943
0.8873 High Similarity NPC32470
0.8865 High Similarity NPC472610
0.8865 High Similarity NPC471731
0.8857 High Similarity NPC472035
0.8857 High Similarity NPC1704
0.8857 High Similarity NPC67650
0.8857 High Similarity NPC478201
0.8849 High Similarity NPC134969
0.8849 High Similarity NPC52358
0.8849 High Similarity NPC247409
0.8846 High Similarity NPC283514
0.8841 High Similarity NPC135837
0.8832 High Similarity NPC470844
0.8828 High Similarity NPC470107
0.8811 High Similarity NPC202112
0.8811 High Similarity NPC51513
0.8811 High Similarity NPC473023
0.8803 High Similarity NPC257025
0.8794 High Similarity NPC474385
0.8794 High Similarity NPC469579
0.8784 High Similarity NPC227062
0.8769 High Similarity NPC198336
0.8768 High Similarity NPC158481
0.8768 High Similarity NPC50455
0.8759 High Similarity NPC270160
0.8759 High Similarity NPC4423
0.8759 High Similarity NPC77325
0.8759 High Similarity NPC237440
0.8759 High Similarity NPC476684
0.875 High Similarity NPC476389
0.875 High Similarity NPC119767
0.875 High Similarity NPC81835
0.8741 High Similarity NPC473271
0.8741 High Similarity NPC134621
0.8741 High Similarity NPC83272
0.8732 High Similarity NPC310340
0.8732 High Similarity NPC472006
0.8732 High Similarity NPC51106
0.8731 High Similarity NPC95537
0.8723 High Similarity NPC37530
0.8723 High Similarity NPC220106
0.8723 High Similarity NPC275734
0.8723 High Similarity NPC182421
0.8723 High Similarity NPC244923
0.8723 High Similarity NPC475730
0.8723 High Similarity NPC130485
0.8723 High Similarity NPC149533
0.8714 High Similarity NPC92655
0.8714 High Similarity NPC275356
0.8707 High Similarity NPC167903
0.8705 High Similarity NPC149372
0.8705 High Similarity NPC474849
0.8705 High Similarity NPC178467
0.8705 High Similarity NPC194579
0.8705 High Similarity NPC65837
0.8705 High Similarity NPC474771
0.8696 High Similarity NPC182496
0.8696 High Similarity NPC180905
0.869 High Similarity NPC106328
0.869 High Similarity NPC35150
0.8686 High Similarity NPC43627
0.8681 High Similarity NPC225173
0.8681 High Similarity NPC471735
0.8681 High Similarity NPC163846
0.8681 High Similarity NPC237208
0.8671 High Similarity NPC280404
0.8671 High Similarity NPC86373
0.8671 High Similarity NPC95123
0.8671 High Similarity NPC210966
0.8671 High Similarity NPC126882
0.8671 High Similarity NPC66404
0.8671 High Similarity NPC478203
0.8671 High Similarity NPC277426
0.8671 High Similarity NPC210425
0.8662 High Similarity NPC82913
0.8662 High Similarity NPC105648
0.8652 High Similarity NPC99441
0.8652 High Similarity NPC316480
0.8643 High Similarity NPC9121
0.8643 High Similarity NPC177307
0.8643 High Similarity NPC12296
0.8643 High Similarity NPC295261
0.8643 High Similarity NPC61590
0.8643 High Similarity NPC107586
0.8643 High Similarity NPC243083
0.8643 High Similarity NPC287246
0.8643 High Similarity NPC212767
0.8643 High Similarity NPC475974
0.8643 High Similarity NPC32441
0.8643 High Similarity NPC13768
0.8643 High Similarity NPC79943
0.8643 High Similarity NPC296490
0.8639 High Similarity NPC227166
0.8639 High Similarity NPC70016
0.8639 High Similarity NPC215921
0.8623 High Similarity NPC474097
0.8621 High Similarity NPC471734
0.8621 High Similarity NPC125801
0.8611 High Similarity NPC29577
0.8611 High Similarity NPC131766
0.8611 High Similarity NPC472034
0.8611 High Similarity NPC473692
0.8611 High Similarity NPC257558
0.8609 High Similarity NPC328093
0.8601 High Similarity NPC476473
0.8601 High Similarity NPC73028
0.8601 High Similarity NPC66593
0.8592 High Similarity NPC90411
0.8582 High Similarity NPC472460
0.8582 High Similarity NPC329225
0.8582 High Similarity NPC147686
0.8582 High Similarity NPC474655
0.8582 High Similarity NPC295339
0.8581 High Similarity NPC474843
0.8571 High Similarity NPC193792
0.8571 High Similarity NPC245058
0.8571 High Similarity NPC472891
0.8571 High Similarity NPC91475
0.8571 High Similarity NPC265910
0.8571 High Similarity NPC119929
0.8571 High Similarity NPC475460
0.8571 High Similarity NPC205766
0.8571 High Similarity NPC295036
0.8571 High Similarity NPC194379
0.8552 High Similarity NPC147250
0.8552 High Similarity NPC470570
0.8552 High Similarity NPC138978
0.8552 High Similarity NPC107625
0.8552 High Similarity NPC472033
0.8542 High Similarity NPC193703
0.8542 High Similarity NPC21599
0.8542 High Similarity NPC48762
0.8542 High Similarity NPC470932
0.854 High Similarity NPC7012
0.8533 High Similarity NPC313299
0.8531 High Similarity NPC322112
0.8531 High Similarity NPC49108
0.8531 High Similarity NPC474300
0.8523 High Similarity NPC125487
0.8523 High Similarity NPC281703
0.8523 High Similarity NPC185103
0.8521 High Similarity NPC222342
0.8521 High Similarity NPC20709
0.8521 High Similarity NPC165172
0.8521 High Similarity NPC254994
0.8521 High Similarity NPC225153
0.8521 High Similarity NPC274784
0.8521 High Similarity NPC265871
0.8521 High Similarity NPC150648

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC261292 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
0.8714 High Similarity NPD970 Clinical (unspecified phase)
0.8643 High Similarity NPD1550 Clinical (unspecified phase)
0.8643 High Similarity NPD1552 Clinical (unspecified phase)
0.8582 High Similarity NPD1549 Phase 2
0.8523 High Similarity NPD7819 Suspended
0.85 High Similarity NPD1510 Phase 2
0.8333 Intermediate Similarity NPD3764 Approved
0.8214 Intermediate Similarity NPD1240 Approved
0.8212 Intermediate Similarity NPD1934 Approved
0.8209 Intermediate Similarity NPD1201 Approved
0.8207 Intermediate Similarity NPD3750 Approved
0.8182 Intermediate Similarity NPD5408 Approved
0.8182 Intermediate Similarity NPD2935 Discontinued
0.8182 Intermediate Similarity NPD5404 Approved
0.8182 Intermediate Similarity NPD5405 Approved
0.8182 Intermediate Similarity NPD5406 Approved
0.8182 Intermediate Similarity NPD9545 Approved
0.8158 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.8117 Intermediate Similarity NPD3749 Approved
0.8117 Intermediate Similarity NPD7075 Discontinued
0.8112 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.8108 Intermediate Similarity NPD2533 Approved
0.8108 Intermediate Similarity NPD2532 Approved
0.8108 Intermediate Similarity NPD2534 Approved
0.8102 Intermediate Similarity NPD1470 Approved
0.8099 Intermediate Similarity NPD1607 Approved
0.8079 Intermediate Similarity NPD4380 Phase 2
0.8056 Intermediate Similarity NPD1551 Phase 2
0.8041 Intermediate Similarity NPD1511 Approved
0.8039 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.803 Intermediate Similarity NPD9493 Approved
0.8026 Intermediate Similarity NPD7411 Suspended
0.8025 Intermediate Similarity NPD6232 Discontinued
0.7987 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.7987 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7971 Intermediate Similarity NPD1164 Approved
0.7971 Intermediate Similarity NPD1203 Approved
0.7962 Intermediate Similarity NPD6959 Discontinued
0.7958 Intermediate Similarity NPD943 Approved
0.7935 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7933 Intermediate Similarity NPD1512 Approved
0.7931 Intermediate Similarity NPD2796 Approved
0.7902 Intermediate Similarity NPD230 Phase 1
0.7895 Intermediate Similarity NPD3226 Approved
0.7891 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7885 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.7877 Intermediate Similarity NPD2346 Discontinued
0.7875 Intermediate Similarity NPD7473 Discontinued
0.7867 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7862 Intermediate Similarity NPD3748 Approved
0.7838 Intermediate Similarity NPD4628 Phase 3
0.7821 Intermediate Similarity NPD7768 Phase 2
0.7812 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7806 Intermediate Similarity NPD1465 Phase 2
0.78 Intermediate Similarity NPD6799 Approved
0.7778 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7778 Intermediate Similarity NPD5844 Phase 1
0.7756 Intermediate Similarity NPD3817 Phase 2
0.7754 Intermediate Similarity NPD1608 Approved
0.7742 Intermediate Similarity NPD6801 Discontinued
0.7727 Intermediate Similarity NPD6599 Discontinued
0.7702 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.7702 Intermediate Similarity NPD6166 Phase 2
0.7702 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.7692 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7692 Intermediate Similarity NPD2801 Approved
0.7682 Intermediate Similarity NPD7390 Discontinued
0.7681 Intermediate Similarity NPD1547 Clinical (unspecified phase)
0.7632 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.763 Intermediate Similarity NPD405 Clinical (unspecified phase)
0.7626 Intermediate Similarity NPD9717 Approved
0.7622 Intermediate Similarity NPD7074 Phase 3
0.7619 Intermediate Similarity NPD7033 Discontinued
0.7619 Intermediate Similarity NPD2799 Discontinued
0.7619 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7619 Intermediate Similarity NPD8150 Discontinued
0.7607 Intermediate Similarity NPD3818 Discontinued
0.76 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.7595 Intermediate Similarity NPD3882 Suspended
0.759 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7578 Intermediate Similarity NPD5710 Approved
0.7578 Intermediate Similarity NPD5711 Approved
0.7569 Intermediate Similarity NPD2313 Discontinued
0.7561 Intermediate Similarity NPD7054 Approved
0.7557 Intermediate Similarity NPD74 Approved
0.7557 Intermediate Similarity NPD9266 Approved
0.7552 Intermediate Similarity NPD6832 Phase 2
0.755 Intermediate Similarity NPD6190 Approved
0.7544 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7536 Intermediate Similarity NPD17 Approved
0.7534 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7532 Intermediate Similarity NPD5403 Approved
0.7532 Intermediate Similarity NPD5402 Approved
0.7518 Intermediate Similarity NPD1283 Approved
0.7517 Intermediate Similarity NPD2344 Approved
0.7516 Intermediate Similarity NPD5401 Approved
0.7515 Intermediate Similarity NPD7472 Approved
0.75 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7481 Intermediate Similarity NPD9267 Approved
0.7481 Intermediate Similarity NPD9265 Clinical (unspecified phase)
0.7481 Intermediate Similarity NPD9264 Approved
0.7481 Intermediate Similarity NPD9263 Approved
0.747 Intermediate Similarity NPD6797 Phase 2
0.7465 Intermediate Similarity NPD2797 Approved
0.7455 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.7453 Intermediate Similarity NPD5494 Approved
0.7451 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7448 Intermediate Similarity NPD411 Approved
0.7448 Intermediate Similarity NPD3268 Approved
0.744 Intermediate Similarity NPD8312 Approved
0.744 Intermediate Similarity NPD8313 Approved
0.7429 Intermediate Similarity NPD1610 Phase 2
0.7425 Intermediate Similarity NPD7251 Discontinued
0.7425 Intermediate Similarity NPD6559 Discontinued
0.7419 Intermediate Similarity NPD920 Approved
0.7417 Intermediate Similarity NPD1243 Approved
0.7415 Intermediate Similarity NPD447 Suspended
0.7413 Intermediate Similarity NPD2798 Approved
0.7403 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7397 Intermediate Similarity NPD520 Approved
0.7394 Intermediate Similarity NPD3225 Approved
0.7383 Intermediate Similarity NPD4308 Phase 3
0.7381 Intermediate Similarity NPD7808 Phase 3
0.7368 Intermediate Similarity NPD7003 Approved
0.7368 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7365 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7355 Intermediate Similarity NPD6273 Approved
0.7333 Intermediate Similarity NPD6100 Approved
0.7333 Intermediate Similarity NPD6099 Approved
0.7326 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.732 Intermediate Similarity NPD2309 Approved
0.7315 Intermediate Similarity NPD4978 Clinical (unspecified phase)
0.7312 Intermediate Similarity NPD4288 Approved
0.7305 Intermediate Similarity NPD1281 Approved
0.7303 Intermediate Similarity NPD2800 Approved
0.7297 Intermediate Similarity NPD1933 Approved
0.729 Intermediate Similarity NPD7422 Clinical (unspecified phase)
0.7289 Intermediate Similarity NPD3751 Discontinued
0.7284 Intermediate Similarity NPD919 Approved
0.7279 Intermediate Similarity NPD6663 Approved
0.7262 Intermediate Similarity NPD5953 Discontinued
0.7254 Intermediate Similarity NPD9269 Phase 2
0.7241 Intermediate Similarity NPD2861 Phase 2
0.7241 Intermediate Similarity NPD5736 Approved
0.723 Intermediate Similarity NPD1613 Approved
0.723 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.723 Intermediate Similarity NPD4060 Phase 1
0.7226 Intermediate Similarity NPD9281 Approved
0.7222 Intermediate Similarity NPD3267 Approved
0.7222 Intermediate Similarity NPD3266 Approved
0.7215 Intermediate Similarity NPD7458 Discontinued
0.7214 Intermediate Similarity NPD9268 Approved
0.7211 Intermediate Similarity NPD6798 Discontinued
0.7197 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7195 Intermediate Similarity NPD7199 Phase 2
0.7192 Intermediate Similarity NPD4908 Phase 1
0.7188 Intermediate Similarity NPD37 Approved
0.7186 Intermediate Similarity NPD7177 Discontinued
0.7183 Intermediate Similarity NPD422 Phase 1
0.7181 Intermediate Similarity NPD6355 Discontinued
0.7178 Intermediate Similarity NPD6234 Discontinued
0.7176 Intermediate Similarity NPD9261 Approved
0.7172 Intermediate Similarity NPD1019 Discontinued
0.7171 Intermediate Similarity NPD7266 Discontinued
0.7163 Intermediate Similarity NPD4626 Approved
0.716 Intermediate Similarity NPD4966 Approved
0.716 Intermediate Similarity NPD4965 Approved
0.716 Intermediate Similarity NPD4967 Phase 2
0.7159 Intermediate Similarity NPD6534 Approved
0.7159 Intermediate Similarity NPD6535 Approved
0.7152 Intermediate Similarity NPD7229 Phase 3
0.7152 Intermediate Similarity NPD3787 Discontinued
0.7143 Intermediate Similarity NPD7286 Phase 2
0.7143 Intermediate Similarity NPD1548 Phase 1
0.7143 Intermediate Similarity NPD8166 Discontinued
0.7133 Intermediate Similarity NPD6651 Approved
0.7133 Intermediate Similarity NPD1481 Phase 2
0.7127 Intermediate Similarity NPD7435 Discontinued
0.7126 Intermediate Similarity NPD4287 Approved
0.7114 Intermediate Similarity NPD2979 Phase 3
0.7114 Intermediate Similarity NPD4307 Phase 2
0.7108 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7105 Intermediate Similarity NPD4477 Approved
0.7105 Intermediate Similarity NPD4476 Approved
0.7105 Intermediate Similarity NPD2438 Suspended
0.7095 Intermediate Similarity NPD1699 Clinical (unspecified phase)
0.7095 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7092 Intermediate Similarity NPD5691 Approved
0.7088 Intermediate Similarity NPD8319 Approved
0.7088 Intermediate Similarity NPD8320 Phase 1
0.7076 Intermediate Similarity NPD4419 Clinical (unspecified phase)
0.7075 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7063 Intermediate Similarity NPD1535 Discovery
0.7059 Intermediate Similarity NPD1471 Phase 3
0.7056 Intermediate Similarity NPD6778 Approved
0.7056 Intermediate Similarity NPD6781 Approved
0.7056 Intermediate Similarity NPD6779 Approved
0.7056 Intermediate Similarity NPD6777 Approved
0.7056 Intermediate Similarity NPD6780 Approved
0.7056 Intermediate Similarity NPD6782 Approved

Structure

External Identifiers

PubChem CID   119199
ChEMBL   CHEMBL69299
ZINC  

Physicochemical Properties

Molecular Weight:  256.07
ALogP:  -0.9997
MLogP:  2.67
XLogP:  3.342
# Rotatable Bonds:  3
Polar Surface Area:  66.76
# H-Bond Aceptor:  2
# H-Bond Donor:  2
# Rings:  3
# Heavy Atoms:  19

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
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Biological Activities  
Similar NPs/Drugs