Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO12079 | Dysoxylum cumingianum | Species | Meliaceae | Eukaryota | Leaves | DOI[10.1021/jo00051a050] |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT112 | Cell Line | MOLT-4 | Homo sapiens | EC50 | < | 4.5 | nM | 7623027 |
NPT407 | Cell Line | COLO 205 | Homo sapiens | TGI | = | 11300 | nM | 9392879 |
NPT391 | Cell Line | HCC 2998 | Homo sapiens | TGI | = | 4900 | nM | 9392879 |
NPT393 | Cell Line | HCT-116 | Homo sapiens | TGI | = | 8700 | nM | 9392879 |
NPT148 | Cell Line | HCT-15 | Homo sapiens | TGI | = | 6300 | nM | 9392879 |
NPT139 | Cell Line | HT-29 | Homo sapiens | TGI | = | 2500 | nM | 9392879 |
NPT386 | Cell Line | KM12 | Homo sapiens | TGI | = | 7600 | nM | 9392879 |
NPT323 | Cell Line | SW-620 | Homo sapiens | TGI | = | 13700 | nM | 9392879 |
NPT4720 | Cell Line | Leukemia cells | Homo sapiens | TGI | = | 11300 | nM | 9392879 |
NPT3877 | Cell Line | NSCLC | Homo sapiens | TGI | = | 12400 | nM | 9392879 |
NPT2 | Others | Unspecified | TGI | = | 7900 | nM | 9392879 | |
NPT2 | Others | Unspecified | TGI | = | 11600 | nM | 9392879 | |
NPT2 | Others | Unspecified | TGI | = | 12600 | nM | 9392879 | |
NPT2 | Others | Unspecified | TGI | = | 12000 | nM | 9392879 | |
NPT2 | Others | Unspecified | TGI | = | 13200 | nM | 9392879 |
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 NPC191915 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 | NPC151214 |
0.9775 | High Similarity | NPC252056 |
0.9444 | High Similarity | NPC57964 |
0.9444 | High Similarity | NPC94582 |
0.9355 | High Similarity | NPC472081 |
0.9355 | High Similarity | NPC476512 |
0.9355 | High Similarity | NPC108227 |
0.9355 | High Similarity | NPC476838 |
0.9355 | High Similarity | NPC476839 |
0.9341 | High Similarity | NPC203434 |
0.9341 | High Similarity | NPC238796 |
0.9341 | High Similarity | NPC237071 |
0.931 | High Similarity | NPC43912 |
0.931 | High Similarity | NPC140446 |
0.9255 | High Similarity | NPC470029 |
0.9255 | High Similarity | NPC310138 |
0.9255 | High Similarity | NPC114700 |
0.9255 | High Similarity | NPC134967 |
0.9247 | High Similarity | NPC470030 |
0.9158 | High Similarity | NPC97260 |
0.9158 | High Similarity | NPC476837 |
0.9158 | High Similarity | NPC139181 |
0.913 | High Similarity | NPC296936 |
0.913 | High Similarity | NPC156377 |
0.9121 | High Similarity | NPC175 |
0.9101 | High Similarity | NPC82955 |
0.9101 | High Similarity | NPC131466 |
0.908 | High Similarity | NPC290612 |
0.9032 | High Similarity | NPC470591 |
0.9022 | High Similarity | NPC473065 |
0.9022 | High Similarity | NPC473067 |
0.9022 | High Similarity | NPC473064 |
0.9011 | High Similarity | NPC473726 |
0.9 | High Similarity | NPC279329 |
0.8989 | High Similarity | NPC281004 |
0.8947 | High Similarity | NPC475574 |
0.8925 | High Similarity | NPC142264 |
0.8925 | High Similarity | NPC476510 |
0.8901 | High Similarity | NPC210759 |
0.8901 | High Similarity | NPC36372 |
0.8901 | High Similarity | NPC293609 |
0.8901 | High Similarity | NPC229801 |
0.8901 | High Similarity | NPC307167 |
0.8889 | High Similarity | NPC102725 |
0.8889 | High Similarity | NPC473472 |
0.8842 | High Similarity | NPC41843 |
0.883 | High Similarity | NPC470028 |
0.883 | High Similarity | NPC472273 |
0.883 | High Similarity | NPC210157 |
0.883 | High Similarity | NPC233649 |
0.8804 | High Similarity | NPC277774 |
0.8804 | High Similarity | NPC167644 |
0.8804 | High Similarity | NPC311246 |
0.8791 | High Similarity | NPC473542 |
0.8791 | High Similarity | NPC65550 |
0.8791 | High Similarity | NPC223143 |
0.8776 | High Similarity | NPC165405 |
0.8764 | High Similarity | NPC471411 |
0.8764 | High Similarity | NPC471410 |
0.871 | High Similarity | NPC305418 |
0.871 | High Similarity | NPC3538 |
0.871 | High Similarity | NPC113500 |
0.871 | High Similarity | NPC477224 |
0.871 | High Similarity | NPC309866 |
0.871 | High Similarity | NPC30687 |
0.871 | High Similarity | NPC45959 |
0.871 | High Similarity | NPC473503 |
0.871 | High Similarity | NPC252253 |
0.8696 | High Similarity | NPC5632 |
0.8696 | High Similarity | NPC476668 |
0.8696 | High Similarity | NPC473066 |
0.8696 | High Similarity | NPC473830 |
0.8696 | High Similarity | NPC204881 |
0.8696 | High Similarity | NPC149966 |
0.8696 | High Similarity | NPC473637 |
0.8632 | High Similarity | NPC475207 |
0.8617 | High Similarity | NPC469710 |
0.8617 | High Similarity | NPC477494 |
0.8617 | High Similarity | NPC215570 |
0.8617 | High Similarity | NPC92196 |
0.8602 | High Similarity | NPC144790 |
0.8602 | High Similarity | NPC137004 |
0.8602 | High Similarity | NPC172838 |
0.8602 | High Similarity | NPC149400 |
0.8602 | High Similarity | NPC88962 |
0.8602 | High Similarity | NPC476669 |
0.86 | High Similarity | NPC472079 |
0.8586 | High Similarity | NPC473199 |
0.8571 | High Similarity | NPC34562 |
0.8557 | High Similarity | NPC477172 |
0.8556 | High Similarity | NPC155531 |
0.8556 | High Similarity | NPC477283 |
0.8556 | High Similarity | NPC215968 |
0.8542 | High Similarity | NPC157739 |
0.8542 | High Similarity | NPC292775 |
0.8542 | High Similarity | NPC209798 |
0.8542 | High Similarity | NPC471374 |
0.8542 | High Similarity | NPC471375 |
0.8539 | High Similarity | NPC474156 |
0.8526 | High Similarity | NPC304011 |
0.8526 | High Similarity | NPC139271 |
0.8526 | High Similarity | NPC473287 |
0.8526 | High Similarity | NPC472989 |
0.8515 | High Similarity | NPC227879 |
0.8515 | High Similarity | NPC208333 |
0.8511 | High Similarity | NPC475436 |
0.8511 | High Similarity | NPC179859 |
0.8511 | High Similarity | NPC253268 |
0.8511 | High Similarity | NPC475325 |
0.8511 | High Similarity | NPC473774 |
0.8511 | High Similarity | NPC174024 |
0.8511 | High Similarity | NPC24960 |
0.8511 | High Similarity | NPC131693 |
0.8511 | High Similarity | NPC473851 |
0.8511 | High Similarity | NPC291547 |
0.8511 | High Similarity | NPC312678 |
0.85 | High Similarity | NPC203974 |
0.8495 | Intermediate Similarity | NPC59006 |
0.8485 | Intermediate Similarity | NPC469827 |
0.8478 | Intermediate Similarity | NPC20822 |
0.8478 | Intermediate Similarity | NPC228059 |
0.8454 | Intermediate Similarity | NPC471426 |
0.8454 | Intermediate Similarity | NPC51579 |
0.8454 | Intermediate Similarity | NPC471427 |
0.8454 | Intermediate Similarity | NPC317019 |
0.8454 | Intermediate Similarity | NPC471428 |
0.8438 | Intermediate Similarity | NPC471770 |
0.8438 | Intermediate Similarity | NPC477222 |
0.8438 | Intermediate Similarity | NPC473555 |
0.8438 | Intermediate Similarity | NPC278939 |
0.8438 | Intermediate Similarity | NPC477223 |
0.8427 | Intermediate Similarity | NPC477285 |
0.8427 | Intermediate Similarity | NPC474346 |
0.8427 | Intermediate Similarity | NPC213737 |
0.8427 | Intermediate Similarity | NPC475820 |
0.8427 | Intermediate Similarity | NPC111582 |
0.8427 | Intermediate Similarity | NPC474253 |
0.8427 | Intermediate Similarity | NPC474284 |
0.8421 | Intermediate Similarity | NPC21897 |
0.8421 | Intermediate Similarity | NPC474399 |
0.8416 | Intermediate Similarity | NPC469826 |
0.8416 | Intermediate Similarity | NPC38217 |
0.8416 | Intermediate Similarity | NPC472988 |
0.8409 | Intermediate Similarity | NPC73515 |
0.8404 | Intermediate Similarity | NPC256104 |
0.8404 | Intermediate Similarity | NPC477547 |
0.8404 | Intermediate Similarity | NPC249204 |
0.8404 | Intermediate Similarity | NPC211845 |
0.8404 | Intermediate Similarity | NPC122083 |
0.8404 | Intermediate Similarity | NPC477451 |
0.8404 | Intermediate Similarity | NPC325828 |
0.8404 | Intermediate Similarity | NPC250393 |
0.8404 | Intermediate Similarity | NPC177834 |
0.8404 | Intermediate Similarity | NPC48339 |
0.8404 | Intermediate Similarity | NPC297348 |
0.8404 | Intermediate Similarity | NPC141769 |
0.8404 | Intermediate Similarity | NPC182740 |
0.8404 | Intermediate Similarity | NPC234352 |
0.837 | Intermediate Similarity | NPC470872 |
0.8367 | Intermediate Similarity | NPC31346 |
0.8367 | Intermediate Similarity | NPC478106 |
0.8351 | Intermediate Similarity | NPC473638 |
0.8333 | Intermediate Similarity | NPC125361 |
0.8333 | Intermediate Similarity | NPC296761 |
0.8333 | Intermediate Similarity | NPC236753 |
0.8333 | Intermediate Similarity | NPC228190 |
0.8333 | Intermediate Similarity | NPC18953 |
0.8333 | Intermediate Similarity | NPC154085 |
0.8333 | Intermediate Similarity | NPC43976 |
0.8333 | Intermediate Similarity | NPC51925 |
0.8333 | Intermediate Similarity | NPC121453 |
0.8317 | Intermediate Similarity | NPC234160 |
0.8316 | Intermediate Similarity | NPC291203 |
0.8316 | Intermediate Similarity | NPC471464 |
0.8316 | Intermediate Similarity | NPC264101 |
0.8316 | Intermediate Similarity | NPC222731 |
0.8316 | Intermediate Similarity | NPC294686 |
0.8316 | Intermediate Similarity | NPC217205 |
0.8315 | Intermediate Similarity | NPC286719 |
0.8315 | Intermediate Similarity | NPC202688 |
0.8315 | Intermediate Similarity | NPC477286 |
0.8315 | Intermediate Similarity | NPC208912 |
0.8315 | Intermediate Similarity | NPC154043 |
0.8315 | Intermediate Similarity | NPC2096 |
0.8315 | Intermediate Similarity | NPC60018 |
0.8276 | Intermediate Similarity | NPC177343 |
0.8269 | Intermediate Similarity | NPC477489 |
0.8265 | Intermediate Similarity | NPC20028 |
0.8261 | Intermediate Similarity | NPC472396 |
0.8247 | Intermediate Similarity | NPC274200 |
0.8247 | Intermediate Similarity | NPC307534 |
0.8247 | Intermediate Similarity | NPC476112 |
0.8242 | Intermediate Similarity | NPC266651 |
0.8242 | Intermediate Similarity | NPC235402 |
0.8235 | Intermediate Similarity | NPC88744 |
0.8229 | Intermediate Similarity | NPC19400 |
0.8229 | Intermediate Similarity | NPC107188 |
0.8229 | Intermediate Similarity | NPC473610 |
0.8229 | Intermediate Similarity | NPC475351 |
0.8229 | Intermediate Similarity | NPC107962 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC191915 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 |
---|---|---|---|
0.8404 | Intermediate Similarity | NPD8171 | Discontinued |
0.7941 | Intermediate Similarity | NPD8170 | Clinical (unspecified phase) |
0.7692 | Intermediate Similarity | NPD6928 | Phase 2 |
0.7685 | Intermediate Similarity | NPD8133 | Approved |
0.7589 | Intermediate Similarity | NPD8377 | Approved |
0.7589 | Intermediate Similarity | NPD8294 | Approved |
0.7568 | Intermediate Similarity | NPD7327 | Approved |
0.7568 | Intermediate Similarity | NPD7328 | Approved |
0.7522 | Intermediate Similarity | NPD8378 | Approved |
0.7522 | Intermediate Similarity | NPD8033 | Approved |
0.7522 | Intermediate Similarity | NPD8296 | Approved |
0.7522 | Intermediate Similarity | NPD8380 | Approved |
0.7522 | Intermediate Similarity | NPD8335 | Approved |
0.7522 | Intermediate Similarity | NPD8379 | Approved |
0.75 | Intermediate Similarity | NPD7516 | Approved |
0.7356 | Intermediate Similarity | NPD4267 | Clinical (unspecified phase) |
0.7315 | Intermediate Similarity | NPD8132 | Clinical (unspecified phase) |
0.7283 | Intermediate Similarity | NPD6697 | Approved |
0.7283 | Intermediate Similarity | NPD6118 | Approved |
0.7283 | Intermediate Similarity | NPD6114 | Approved |
0.7283 | Intermediate Similarity | NPD6115 | Approved |
0.7263 | Intermediate Similarity | NPD3670 | Clinical (unspecified phase) |
0.7263 | Intermediate Similarity | NPD3669 | Approved |
0.7232 | Intermediate Similarity | NPD6940 | Discontinued |
0.7174 | Intermediate Similarity | NPD6116 | Phase 1 |
0.7119 | Intermediate Similarity | NPD7507 | Approved |
0.7069 | Intermediate Similarity | NPD7503 | Approved |
0.7065 | Intermediate Similarity | NPD6117 | Approved |
0.7033 | Intermediate Similarity | NPD1811 | Approved |
0.7033 | Intermediate Similarity | NPD1810 | Approved |
0.7018 | Intermediate Similarity | NPD8295 | Clinical (unspecified phase) |
0.6942 | Remote Similarity | NPD7319 | Approved |
0.6889 | Remote Similarity | NPD7532 | Clinical (unspecified phase) |
0.6848 | Remote Similarity | NPD6113 | Clinical (unspecified phase) |
0.6827 | Remote Similarity | NPD7991 | Discontinued |
0.6818 | Remote Similarity | NPD6412 | Phase 2 |
0.6721 | Remote Similarity | NPD7736 | Approved |
0.6703 | Remote Similarity | NPD2686 | Approved |
0.6703 | Remote Similarity | NPD2687 | Approved |
0.6703 | Remote Similarity | NPD2254 | Approved |
0.6699 | Remote Similarity | NPD8035 | Phase 2 |
0.6699 | Remote Similarity | NPD8034 | Phase 2 |
0.6667 | Remote Similarity | NPD8328 | Phase 3 |
0.6607 | Remote Similarity | NPD8174 | Phase 2 |
0.6607 | Remote Similarity | NPD6686 | Approved |
0.6531 | Remote Similarity | NPD1779 | Approved |
0.6531 | Remote Similarity | NPD1780 | Approved |
0.6504 | Remote Similarity | NPD8293 | Discontinued |
0.6452 | Remote Similarity | NPD4808 | Clinical (unspecified phase) |
0.6452 | Remote Similarity | NPD4809 | Clinical (unspecified phase) |
0.6436 | Remote Similarity | NPD7520 | Clinical (unspecified phase) |
0.6421 | Remote Similarity | NPD3702 | Approved |
0.6421 | Remote Similarity | NPD3703 | Phase 2 |
0.6404 | Remote Similarity | NPD371 | Approved |
0.6344 | Remote Similarity | NPD4787 | Phase 1 |
0.633 | Remote Similarity | NPD7638 | Approved |
0.6316 | Remote Similarity | NPD5345 | Clinical (unspecified phase) |
0.6311 | Remote Similarity | NPD6370 | Approved |
0.6273 | Remote Similarity | NPD7639 | Approved |
0.6273 | Remote Similarity | NPD7640 | Approved |
0.6263 | Remote Similarity | NPD7525 | Registered |
0.6261 | Remote Similarity | NPD4061 | Clinical (unspecified phase) |
0.6239 | Remote Similarity | NPD8297 | Approved |
0.6239 | Remote Similarity | NPD6882 | Approved |
0.6237 | Remote Similarity | NPD3700 | Clinical (unspecified phase) |
0.6237 | Remote Similarity | NPD3699 | Clinical (unspecified phase) |
0.6216 | Remote Similarity | NPD1700 | Approved |
0.621 | Remote Similarity | NPD7492 | Approved |
0.6167 | Remote Similarity | NPD6009 | Approved |
0.6161 | Remote Similarity | NPD7632 | Discontinued |
0.616 | Remote Similarity | NPD6616 | Approved |
0.6148 | Remote Similarity | NPD6054 | Approved |
0.6148 | Remote Similarity | NPD6319 | Approved |
0.6148 | Remote Similarity | NPD6059 | Approved |
0.6129 | Remote Similarity | NPD5361 | Clinical (unspecified phase) |
0.6129 | Remote Similarity | NPD5360 | Phase 3 |
0.6126 | Remote Similarity | NPD8418 | Phase 2 |
0.6111 | Remote Similarity | NPD7078 | Approved |
0.6105 | Remote Similarity | NPD5777 | Approved |
0.6105 | Remote Similarity | NPD6081 | Approved |
0.6068 | Remote Similarity | NPD5955 | Clinical (unspecified phase) |
0.6053 | Remote Similarity | NPD4056 | Clinical (unspecified phase) |
0.6053 | Remote Similarity | NPD4057 | Clinical (unspecified phase) |
0.605 | Remote Similarity | NPD4632 | Approved |
0.6033 | Remote Similarity | NPD7115 | Discovery |
0.6014 | Remote Similarity | NPD7625 | Phase 1 |
0.6 | Remote Similarity | NPD7604 | Phase 2 |
0.6 | Remote Similarity | NPD4244 | Approved |
0.6 | Remote Similarity | NPD4789 | Approved |
0.6 | Remote Similarity | NPD6675 | Approved |
0.6 | Remote Similarity | NPD5739 | Approved |
0.6 | Remote Similarity | NPD7128 | Approved |
0.6 | Remote Similarity | NPD4245 | Approved |
0.6 | Remote Similarity | NPD6402 | Approved |
0.5983 | Remote Similarity | NPD6372 | Approved |
0.5983 | Remote Similarity | NPD6373 | Approved |
0.5968 | Remote Similarity | NPD8517 | Approved |
0.5968 | Remote Similarity | NPD6015 | Approved |
0.5968 | Remote Similarity | NPD6016 | Approved |
0.5968 | Remote Similarity | NPD8513 | Phase 3 |
0.5968 | Remote Similarity | NPD8515 | Approved |
0.5968 | Remote Similarity | NPD8516 | Approved |
0.592 | Remote Similarity | NPD5988 | Approved |
0.5914 | Remote Similarity | NPD4224 | Phase 2 |
0.5897 | Remote Similarity | NPD7320 | Approved |
0.5897 | Remote Similarity | NPD6881 | Approved |
0.5897 | Remote Similarity | NPD6899 | Approved |
0.5895 | Remote Similarity | NPD3698 | Phase 2 |
0.5882 | Remote Similarity | NPD8130 | Phase 1 |
0.5882 | Remote Similarity | NPD6649 | Approved |
0.5882 | Remote Similarity | NPD6650 | Approved |
0.5878 | Remote Similarity | NPD8449 | Approved |
0.5877 | Remote Similarity | NPD8138 | Approved |
0.5877 | Remote Similarity | NPD8086 | Approved |
0.5877 | Remote Similarity | NPD8083 | Approved |
0.5877 | Remote Similarity | NPD8082 | Approved |
0.5877 | Remote Similarity | NPD8139 | Approved |
0.5877 | Remote Similarity | NPD8085 | Approved |
0.5877 | Remote Similarity | NPD8084 | Approved |
0.5873 | Remote Similarity | NPD6067 | Discontinued |
0.5872 | Remote Similarity | NPD6399 | Phase 3 |
0.5849 | Remote Similarity | NPD7524 | Approved |
0.584 | Remote Similarity | NPD6921 | Approved |
0.5833 | Remote Similarity | NPD8450 | Suspended |
0.5826 | Remote Similarity | NPD8276 | Approved |
0.5826 | Remote Similarity | NPD8275 | Approved |
0.5818 | Remote Similarity | NPD7748 | Approved |
0.5812 | Remote Similarity | NPD5954 | Clinical (unspecified phase) |
0.5812 | Remote Similarity | NPD5701 | Approved |
0.5812 | Remote Similarity | NPD5697 | Approved |
0.5806 | Remote Similarity | NPD3171 | Clinical (unspecified phase) |
0.5804 | Remote Similarity | NPD7902 | Approved |
0.5798 | Remote Similarity | NPD7290 | Approved |
0.5798 | Remote Similarity | NPD6883 | Approved |
0.5798 | Remote Similarity | NPD7102 | Approved |
0.5776 | Remote Similarity | NPD8081 | Approved |
0.5773 | Remote Similarity | NPD4758 | Discontinued |
0.5755 | Remote Similarity | NPD8308 | Discontinued |
0.575 | Remote Similarity | NPD6869 | Approved |
0.575 | Remote Similarity | NPD6847 | Approved |
0.575 | Remote Similarity | NPD6617 | Approved |
0.5743 | Remote Similarity | NPD3671 | Phase 1 |
0.5743 | Remote Similarity | NPD5364 | Discontinued |
0.5726 | Remote Similarity | NPD6008 | Approved |
0.5726 | Remote Similarity | NPD8393 | Approved |
0.5714 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD6123 | Approved |
0.5714 | Remote Similarity | NPD5983 | Phase 2 |
0.5714 | Remote Similarity | NPD6014 | Approved |
0.5714 | Remote Similarity | NPD6012 | Approved |
0.5714 | Remote Similarity | NPD6013 | Approved |
0.5692 | Remote Similarity | NPD6033 | Approved |
0.5688 | Remote Similarity | NPD6701 | Clinical (unspecified phase) |
0.5688 | Remote Similarity | NPD6700 | Approved |
0.5686 | Remote Similarity | NPD7645 | Phase 2 |
0.5678 | Remote Similarity | NPD7646 | Clinical (unspecified phase) |
0.5678 | Remote Similarity | NPD8307 | Discontinued |
0.5678 | Remote Similarity | NPD8140 | Approved |
0.5664 | Remote Similarity | NPD6084 | Phase 2 |
0.5664 | Remote Similarity | NPD6083 | Phase 2 |
0.5659 | Remote Similarity | NPD6336 | Discontinued |
0.5652 | Remote Similarity | NPD5344 | Discontinued |
0.5636 | Remote Similarity | NPD7515 | Phase 2 |
0.5636 | Remote Similarity | NPD6703 | Approved |
0.5636 | Remote Similarity | NPD6702 | Approved |
0.563 | Remote Similarity | NPD6011 | Approved |
0.562 | Remote Similarity | NPD6401 | Clinical (unspecified phase) |
0.562 | Remote Similarity | NPD8413 | Clinical (unspecified phase) |
0.5619 | Remote Similarity | NPD6695 | Phase 3 |
0.5614 | Remote Similarity | NPD4225 | Approved |
PubChem CID   | 9987638 |
ChEMBL   | CHEMBL503335 |
ZINC   |
Molecular Weight:   | 752.47 |
ALogP:   | -0.5551 |
MLogP:   | 4.65 |
XLogP:   | 6.497 |
# Rotatable Bonds:   | 28 |
Polar Surface Area:   | 181.44 |
# H-Bond Aceptor:   | 12 |
# H-Bond Donor:   | 5 |
# Rings:   | 6 |
# Heavy Atoms:   | 53 |