Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Inhibition | = | 39.2 | % | 23398362 | |
NPT80 | Cell Line | Raji | Homo sapiens | Activity | = | 70 | % | 18321710 |
NPT2 | Others | Unspecified | Inhibition | = | 100 | % | 18077425 | |
NPT2 | Others | Unspecified | Inhibition | = | 16.1 | % | 19349520 | |
NPT2 | Others | Unspecified | Inhibition | = | 83.7 | % | 8946743 |
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 NPC93352 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 |
---|---|---|
0.9796 | High Similarity | NPC33053 |
0.9592 | High Similarity | NPC75608 |
0.9485 | High Similarity | NPC470434 |
0.9485 | High Similarity | NPC285231 |
0.9485 | High Similarity | NPC21568 |
0.9406 | High Similarity | NPC157530 |
0.9406 | High Similarity | NPC250089 |
0.9406 | High Similarity | NPC14630 |
0.9406 | High Similarity | NPC472901 |
0.9381 | High Similarity | NPC469942 |
0.9375 | High Similarity | NPC243728 |
0.9375 | High Similarity | NPC473890 |
0.9314 | High Similarity | NPC103627 |
0.9314 | High Similarity | NPC191439 |
0.9314 | High Similarity | NPC170974 |
0.93 | High Similarity | NPC472900 |
0.93 | High Similarity | NPC472898 |
0.93 | High Similarity | NPC472899 |
0.9293 | High Similarity | NPC473198 |
0.9278 | High Similarity | NPC158088 |
0.9223 | High Similarity | NPC472987 |
0.9223 | High Similarity | NPC13190 |
0.9223 | High Similarity | NPC473021 |
0.9216 | High Similarity | NPC28844 |
0.9216 | High Similarity | NPC473328 |
0.9216 | High Similarity | NPC473318 |
0.92 | High Similarity | NPC221562 |
0.92 | High Similarity | NPC470885 |
0.92 | High Similarity | NPC187400 |
0.9192 | High Similarity | NPC272015 |
0.9192 | High Similarity | NPC136816 |
0.9184 | High Similarity | NPC282669 |
0.9184 | High Similarity | NPC473200 |
0.9184 | High Similarity | NPC7341 |
0.9135 | High Similarity | NPC112274 |
0.9135 | High Similarity | NPC231797 |
0.9135 | High Similarity | NPC473567 |
0.9135 | High Similarity | NPC216595 |
0.9126 | High Similarity | NPC65155 |
0.9109 | High Similarity | NPC309448 |
0.9109 | High Similarity | NPC473923 |
0.9109 | High Similarity | NPC473476 |
0.9109 | High Similarity | NPC242748 |
0.91 | High Similarity | NPC473124 |
0.91 | High Similarity | NPC473123 |
0.9091 | High Similarity | NPC4831 |
0.9091 | High Similarity | NPC472023 |
0.9091 | High Similarity | NPC309425 |
0.9091 | High Similarity | NPC160734 |
0.9091 | High Similarity | NPC88000 |
0.9091 | High Similarity | NPC129372 |
0.9091 | High Similarity | NPC267510 |
0.9091 | High Similarity | NPC47566 |
0.9082 | High Similarity | NPC234287 |
0.9082 | High Similarity | NPC280825 |
0.9072 | High Similarity | NPC207617 |
0.9057 | High Similarity | NPC207637 |
0.9048 | High Similarity | NPC51154 |
0.9038 | High Similarity | NPC65034 |
0.9038 | High Similarity | NPC208189 |
0.902 | High Similarity | NPC190395 |
0.902 | High Similarity | NPC231340 |
0.902 | High Similarity | NPC226642 |
0.901 | High Similarity | NPC473127 |
0.901 | High Similarity | NPC203354 |
0.901 | High Similarity | NPC110656 |
0.9 | High Similarity | NPC312553 |
0.9 | High Similarity | NPC159036 |
0.9 | High Similarity | NPC288694 |
0.899 | High Similarity | NPC64348 |
0.8962 | High Similarity | NPC11548 |
0.8952 | High Similarity | NPC42171 |
0.8942 | High Similarity | NPC141433 |
0.8932 | High Similarity | NPC476541 |
0.8932 | High Similarity | NPC472897 |
0.8932 | High Similarity | NPC476539 |
0.8932 | High Similarity | NPC476540 |
0.8932 | High Similarity | NPC476538 |
0.8932 | High Similarity | NPC472896 |
0.8922 | High Similarity | NPC181845 |
0.8922 | High Similarity | NPC474569 |
0.8911 | High Similarity | NPC31907 |
0.8911 | High Similarity | NPC472252 |
0.8911 | High Similarity | NPC157659 |
0.8911 | High Similarity | NPC286969 |
0.8911 | High Similarity | NPC155010 |
0.8911 | High Similarity | NPC473020 |
0.8911 | High Similarity | NPC189852 |
0.8911 | High Similarity | NPC245280 |
0.8911 | High Similarity | NPC213190 |
0.8911 | High Similarity | NPC114874 |
0.8911 | High Similarity | NPC16520 |
0.8911 | High Similarity | NPC8039 |
0.8911 | High Similarity | NPC211879 |
0.8911 | High Similarity | NPC120123 |
0.8911 | High Similarity | NPC16573 |
0.8911 | High Similarity | NPC131479 |
0.8889 | High Similarity | NPC45475 |
0.8879 | High Similarity | NPC148965 |
0.8879 | High Similarity | NPC477030 |
0.8879 | High Similarity | NPC477029 |
0.8866 | High Similarity | NPC477927 |
0.8866 | High Similarity | NPC72817 |
0.8846 | High Similarity | NPC475670 |
0.8846 | High Similarity | NPC477026 |
0.8846 | High Similarity | NPC302057 |
0.8846 | High Similarity | NPC306131 |
0.8846 | High Similarity | NPC477027 |
0.8846 | High Similarity | NPC70204 |
0.8835 | High Similarity | NPC470432 |
0.8835 | High Similarity | NPC305423 |
0.8835 | High Similarity | NPC94272 |
0.8835 | High Similarity | NPC283829 |
0.8835 | High Similarity | NPC473469 |
0.8835 | High Similarity | NPC230507 |
0.8835 | High Similarity | NPC113044 |
0.8835 | High Similarity | NPC161676 |
0.8835 | High Similarity | NPC281939 |
0.8835 | High Similarity | NPC14704 |
0.8824 | High Similarity | NPC165033 |
0.8824 | High Similarity | NPC273879 |
0.8812 | High Similarity | NPC154452 |
0.8796 | High Similarity | NPC203862 |
0.8788 | High Similarity | NPC240372 |
0.8774 | High Similarity | NPC475354 |
0.8762 | High Similarity | NPC52241 |
0.8762 | High Similarity | NPC475317 |
0.8762 | High Similarity | NPC154856 |
0.8762 | High Similarity | NPC472717 |
0.875 | High Similarity | NPC7213 |
0.875 | High Similarity | NPC38376 |
0.875 | High Similarity | NPC80210 |
0.875 | High Similarity | NPC295980 |
0.875 | High Similarity | NPC98696 |
0.875 | High Similarity | NPC235824 |
0.8738 | High Similarity | NPC208594 |
0.8738 | High Similarity | NPC152584 |
0.8738 | High Similarity | NPC269627 |
0.8738 | High Similarity | NPC473199 |
0.8738 | High Similarity | NPC160816 |
0.8738 | High Similarity | NPC194842 |
0.8738 | High Similarity | NPC208477 |
0.8738 | High Similarity | NPC127801 |
0.8738 | High Similarity | NPC69737 |
0.8738 | High Similarity | NPC26798 |
0.8725 | High Similarity | NPC471885 |
0.8725 | High Similarity | NPC471887 |
0.8725 | High Similarity | NPC162354 |
0.8725 | High Similarity | NPC474124 |
0.8725 | High Similarity | NPC471888 |
0.8725 | High Similarity | NPC471886 |
0.8716 | High Similarity | NPC475403 |
0.8716 | High Similarity | NPC160888 |
0.8713 | High Similarity | NPC121072 |
0.8713 | High Similarity | NPC21064 |
0.8713 | High Similarity | NPC176406 |
0.8704 | High Similarity | NPC146652 |
0.87 | High Similarity | NPC5358 |
0.87 | High Similarity | NPC476895 |
0.87 | High Similarity | NPC216260 |
0.8692 | High Similarity | NPC307642 |
0.8692 | High Similarity | NPC469348 |
0.8692 | High Similarity | NPC469347 |
0.8687 | High Similarity | NPC472989 |
0.8687 | High Similarity | NPC90583 |
0.8679 | High Similarity | NPC475247 |
0.8679 | High Similarity | NPC472715 |
0.8679 | High Similarity | NPC114188 |
0.8679 | High Similarity | NPC294129 |
0.8679 | High Similarity | NPC197231 |
0.8673 | High Similarity | NPC305160 |
0.8667 | High Similarity | NPC232054 |
0.8667 | High Similarity | NPC475550 |
0.8667 | High Similarity | NPC42482 |
0.8667 | High Similarity | NPC194207 |
0.8667 | High Similarity | NPC195116 |
0.8667 | High Similarity | NPC248746 |
0.8667 | High Similarity | NPC171073 |
0.8667 | High Similarity | NPC300557 |
0.8667 | High Similarity | NPC208383 |
0.8667 | High Similarity | NPC46190 |
0.8667 | High Similarity | NPC470433 |
0.8667 | High Similarity | NPC40440 |
0.8667 | High Similarity | NPC475333 |
0.8667 | High Similarity | NPC285253 |
0.8667 | High Similarity | NPC6806 |
0.8667 | High Similarity | NPC221110 |
0.8667 | High Similarity | NPC84956 |
0.8667 | High Similarity | NPC180459 |
0.8667 | High Similarity | NPC73243 |
0.8667 | High Similarity | NPC102016 |
0.8667 | High Similarity | NPC218571 |
0.8667 | High Similarity | NPC22779 |
0.8667 | High Similarity | NPC128133 |
0.8667 | High Similarity | NPC224098 |
0.8667 | High Similarity | NPC150372 |
0.8667 | High Similarity | NPC244086 |
0.8667 | High Similarity | NPC249265 |
0.8667 | High Similarity | NPC477809 |
0.8667 | High Similarity | NPC95051 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC93352 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 |
---|---|---|---|
0.8482 | Intermediate Similarity | NPD8033 | Approved |
0.8393 | Intermediate Similarity | NPD8377 | Approved |
0.8393 | Intermediate Similarity | NPD8294 | Approved |
0.8378 | Intermediate Similarity | NPD7328 | Approved |
0.8378 | Intermediate Similarity | NPD7327 | Approved |
0.8319 | Intermediate Similarity | NPD8296 | Approved |
0.8319 | Intermediate Similarity | NPD8335 | Approved |
0.8319 | Intermediate Similarity | NPD8380 | Approved |
0.8319 | Intermediate Similarity | NPD8379 | Approved |
0.8319 | Intermediate Similarity | NPD8378 | Approved |
0.8304 | Intermediate Similarity | NPD7516 | Approved |
0.8158 | Intermediate Similarity | NPD7503 | Approved |
0.7963 | Intermediate Similarity | NPD6412 | Phase 2 |
0.789 | Intermediate Similarity | NPD6686 | Approved |
0.7881 | Intermediate Similarity | NPD7507 | Approved |
0.7699 | Intermediate Similarity | NPD8133 | Approved |
0.7686 | Intermediate Similarity | NPD7319 | Approved |
0.75 | Intermediate Similarity | NPD8132 | Clinical (unspecified phase) |
0.7353 | Intermediate Similarity | NPD7524 | Approved |
0.7333 | Intermediate Similarity | NPD8171 | Discontinued |
0.7315 | Intermediate Similarity | NPD7638 | Approved |
0.7248 | Intermediate Similarity | NPD7640 | Approved |
0.7248 | Intermediate Similarity | NPD7639 | Approved |
0.7228 | Intermediate Similarity | NPD7338 | Clinical (unspecified phase) |
0.7222 | Intermediate Similarity | NPD8449 | Approved |
0.7203 | Intermediate Similarity | NPD8295 | Clinical (unspecified phase) |
0.7188 | Intermediate Similarity | NPD6942 | Approved |
0.7188 | Intermediate Similarity | NPD7339 | Approved |
0.7172 | Intermediate Similarity | NPD7525 | Registered |
0.7165 | Intermediate Similarity | NPD8450 | Suspended |
0.7131 | Intermediate Similarity | NPD8328 | Phase 3 |
0.7129 | Intermediate Similarity | NPD6695 | Phase 3 |
0.7107 | Intermediate Similarity | NPD8513 | Phase 3 |
0.7107 | Intermediate Similarity | NPD8517 | Approved |
0.7107 | Intermediate Similarity | NPD8516 | Approved |
0.7107 | Intermediate Similarity | NPD8515 | Approved |
0.7059 | Intermediate Similarity | NPD7115 | Discovery |
0.7049 | Intermediate Similarity | NPD6370 | Approved |
0.704 | Intermediate Similarity | NPD7736 | Approved |
0.7019 | Intermediate Similarity | NPD4751 | Clinical (unspecified phase) |
0.7019 | Intermediate Similarity | NPD7750 | Discontinued |
0.696 | Remote Similarity | NPD8293 | Discontinued |
0.6939 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.69 | Remote Similarity | NPD7645 | Phase 2 |
0.69 | Remote Similarity | NPD6929 | Approved |
0.6885 | Remote Similarity | NPD6054 | Approved |
0.6885 | Remote Similarity | NPD6059 | Approved |
0.6852 | Remote Similarity | NPD6399 | Phase 3 |
0.6847 | Remote Similarity | NPD4225 | Approved |
0.6832 | Remote Similarity | NPD6930 | Phase 2 |
0.6832 | Remote Similarity | NPD6931 | Approved |
0.678 | Remote Similarity | NPD8413 | Clinical (unspecified phase) |
0.6768 | Remote Similarity | NPD6933 | Approved |
0.6752 | Remote Similarity | NPD4061 | Clinical (unspecified phase) |
0.6731 | Remote Similarity | NPD4786 | Approved |
0.6729 | Remote Similarity | NPD6051 | Approved |
0.6726 | Remote Similarity | NPD4159 | Approved |
0.6723 | Remote Similarity | NPD6882 | Approved |
0.6723 | Remote Similarity | NPD8297 | Approved |
0.672 | Remote Similarity | NPD6067 | Discontinued |
0.67 | Remote Similarity | NPD5776 | Phase 2 |
0.67 | Remote Similarity | NPD6925 | Approved |
0.6696 | Remote Similarity | NPD8170 | Clinical (unspecified phase) |
0.6694 | Remote Similarity | NPD6015 | Approved |
0.6694 | Remote Similarity | NPD6016 | Approved |
0.6667 | Remote Similarity | NPD7514 | Phase 3 |
0.6667 | Remote Similarity | NPD7492 | Approved |
0.6667 | Remote Similarity | NPD6928 | Phase 2 |
0.6667 | Remote Similarity | NPD7625 | Phase 1 |
0.6667 | Remote Similarity | NPD7632 | Discontinued |
0.664 | Remote Similarity | NPD5988 | Approved |
0.6639 | Remote Similarity | NPD6009 | Approved |
0.6634 | Remote Similarity | NPD7145 | Approved |
0.6614 | Remote Similarity | NPD6616 | Approved |
0.6613 | Remote Similarity | NPD6319 | Approved |
0.6606 | Remote Similarity | NPD7087 | Discontinued |
0.6606 | Remote Similarity | NPD7637 | Suspended |
0.6602 | Remote Similarity | NPD6902 | Approved |
0.6579 | Remote Similarity | NPD5344 | Discontinued |
0.6571 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.6566 | Remote Similarity | NPD6926 | Approved |
0.6566 | Remote Similarity | NPD6924 | Approved |
0.6562 | Remote Similarity | NPD7078 | Approved |
0.6555 | Remote Similarity | NPD5955 | Clinical (unspecified phase) |
0.6549 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.6538 | Remote Similarity | NPD3667 | Approved |
0.6535 | Remote Similarity | NPD6932 | Approved |
0.6529 | Remote Similarity | NPD4632 | Approved |
0.6514 | Remote Similarity | NPD6698 | Approved |
0.6514 | Remote Similarity | NPD7838 | Discovery |
0.6514 | Remote Similarity | NPD46 | Approved |
0.6509 | Remote Similarity | NPD6893 | Approved |
0.6505 | Remote Similarity | NPD7332 | Phase 2 |
0.6496 | Remote Similarity | NPD7128 | Approved |
0.6496 | Remote Similarity | NPD6640 | Phase 3 |
0.6496 | Remote Similarity | NPD5739 | Approved |
0.6496 | Remote Similarity | NPD6675 | Approved |
0.6496 | Remote Similarity | NPD6402 | Approved |
0.6471 | Remote Similarity | NPD6372 | Approved |
0.6471 | Remote Similarity | NPD6373 | Approved |
0.6455 | Remote Similarity | NPD8035 | Phase 2 |
0.6455 | Remote Similarity | NPD8034 | Phase 2 |
0.6446 | Remote Similarity | NPD6053 | Discontinued |
0.6434 | Remote Similarity | NPD8074 | Phase 3 |
0.6422 | Remote Similarity | NPD5328 | Approved |
0.6408 | Remote Similarity | NPD6683 | Phase 2 |
0.64 | Remote Similarity | NPD4784 | Approved |
0.64 | Remote Similarity | NPD4785 | Approved |
0.6387 | Remote Similarity | NPD6881 | Approved |
0.6387 | Remote Similarity | NPD7320 | Approved |
0.6387 | Remote Similarity | NPD6899 | Approved |
0.6387 | Remote Similarity | NPD5345 | Clinical (unspecified phase) |
0.6385 | Remote Similarity | NPD6033 | Approved |
0.6378 | Remote Similarity | NPD5125 | Phase 3 |
0.6378 | Remote Similarity | NPD5126 | Approved |
0.6364 | Remote Similarity | NPD6649 | Approved |
0.6364 | Remote Similarity | NPD7151 | Approved |
0.6364 | Remote Similarity | NPD6650 | Approved |
0.6364 | Remote Similarity | NPD4243 | Approved |
0.6364 | Remote Similarity | NPD7150 | Approved |
0.6364 | Remote Similarity | NPD8130 | Phase 1 |
0.6364 | Remote Similarity | NPD7152 | Approved |
0.6339 | Remote Similarity | NPD7748 | Approved |
0.6327 | Remote Similarity | NPD6923 | Approved |
0.6327 | Remote Similarity | NPD6922 | Approved |
0.6316 | Remote Similarity | NPD6084 | Phase 2 |
0.6316 | Remote Similarity | NPD4755 | Approved |
0.6316 | Remote Similarity | NPD6083 | Phase 2 |
0.6316 | Remote Similarity | NPD7902 | Approved |
0.6306 | Remote Similarity | NPD6079 | Approved |
0.6303 | Remote Similarity | NPD5701 | Approved |
0.6303 | Remote Similarity | NPD5954 | Clinical (unspecified phase) |
0.6303 | Remote Similarity | NPD5697 | Approved |
0.6296 | Remote Similarity | NPD3618 | Phase 1 |
0.6286 | Remote Similarity | NPD6898 | Phase 1 |
0.6281 | Remote Similarity | NPD7290 | Approved |
0.6281 | Remote Similarity | NPD4634 | Approved |
0.6281 | Remote Similarity | NPD6883 | Approved |
0.6281 | Remote Similarity | NPD7102 | Approved |
0.6263 | Remote Similarity | NPD7144 | Approved |
0.6263 | Remote Similarity | NPD7143 | Approved |
0.625 | Remote Similarity | NPD4202 | Approved |
0.6239 | Remote Similarity | NPD5211 | Phase 2 |
0.623 | Remote Similarity | NPD6847 | Approved |
0.623 | Remote Similarity | NPD6869 | Approved |
0.623 | Remote Similarity | NPD6617 | Approved |
0.622 | Remote Similarity | NPD7741 | Discontinued |
0.6218 | Remote Similarity | NPD6008 | Approved |
0.6216 | Remote Similarity | NPD3168 | Discontinued |
0.6207 | Remote Similarity | NPD6648 | Approved |
0.6207 | Remote Similarity | NPD5286 | Approved |
0.6207 | Remote Similarity | NPD4700 | Approved |
0.6207 | Remote Similarity | NPD4696 | Approved |
0.6207 | Remote Similarity | NPD5285 | Approved |
0.6204 | Remote Similarity | NPD7520 | Clinical (unspecified phase) |
0.6202 | Remote Similarity | NPD7604 | Phase 2 |
0.6198 | Remote Similarity | NPD6013 | Approved |
0.6198 | Remote Similarity | NPD6014 | Approved |
0.6198 | Remote Similarity | NPD6012 | Approved |
0.619 | Remote Similarity | NPD4748 | Discontinued |
0.619 | Remote Similarity | NPD7509 | Discontinued |
0.6176 | Remote Similarity | NPD8264 | Approved |
0.6172 | Remote Similarity | NPD5983 | Phase 2 |
0.6162 | Remote Similarity | NPD4267 | Clinical (unspecified phase) |
0.6161 | Remote Similarity | NPD7515 | Phase 2 |
0.6154 | Remote Similarity | NPD7322 | Clinical (unspecified phase) |
0.6134 | Remote Similarity | NPD5141 | Approved |
0.6126 | Remote Similarity | NPD4753 | Phase 2 |
0.6119 | Remote Similarity | NPD7260 | Phase 2 |
0.6116 | Remote Similarity | NPD6011 | Approved |
0.6111 | Remote Similarity | NPD3665 | Phase 1 |
0.6111 | Remote Similarity | NPD3133 | Approved |
0.6111 | Remote Similarity | NPD3668 | Phase 3 |
0.6111 | Remote Similarity | NPD3666 | Approved |
0.6107 | Remote Similarity | NPD6336 | Discontinued |
0.6102 | Remote Similarity | NPD5224 | Approved |
0.6102 | Remote Similarity | NPD5225 | Approved |
0.6102 | Remote Similarity | NPD4633 | Approved |
0.6102 | Remote Similarity | NPD5226 | Approved |
0.6098 | Remote Similarity | NPD6401 | Clinical (unspecified phase) |
0.6087 | Remote Similarity | NPD5222 | Approved |
0.6087 | Remote Similarity | NPD5221 | Approved |
0.6087 | Remote Similarity | NPD5220 | Clinical (unspecified phase) |
0.6087 | Remote Similarity | NPD4697 | Phase 3 |
0.6083 | Remote Similarity | NPD4767 | Approved |
0.6083 | Remote Similarity | NPD4768 | Approved |
0.6078 | Remote Similarity | NPD1811 | Approved |
0.6078 | Remote Similarity | NPD1810 | Approved |
0.6053 | Remote Similarity | NPD7900 | Approved |
0.6053 | Remote Similarity | NPD7901 | Clinical (unspecified phase) |
0.605 | Remote Similarity | NPD5174 | Approved |
0.605 | Remote Similarity | NPD5175 | Approved |
0.6045 | Remote Similarity | NPD5956 | Approved |
0.6036 | Remote Similarity | NPD5737 | Approved |
0.6036 | Remote Similarity | NPD7513 | Clinical (unspecified phase) |
0.6036 | Remote Similarity | NPD6672 | Approved |
0.6034 | Remote Similarity | NPD5173 | Approved |
0.6033 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.6019 | Remote Similarity | NPD4190 | Phase 3 |
0.6019 | Remote Similarity | NPD5275 | Approved |
PubChem CID   | 44445582 |
ChEMBL   | CHEMBL251069 |
ZINC   |
Molecular Weight:   | 648.46 |
ALogP:   | 1.6005 |
MLogP:   | 4.76 |
XLogP:   | 7.247 |
# Rotatable Bonds:   | 23 |
Polar Surface Area:   | 117.84 |
# H-Bond Aceptor:   | 8 |
# H-Bond Donor:   | 4 |
# Rings:   | 5 |
# Heavy Atoms:   | 46 |