Drug ID:   | NPD1802 |
Drug Name:   | Tetracaine |
Molecular Formula:   | C15H24N2O2 |
Canonical SMILES:   | CCCCNc1ccc(cc1)C(=O)OCCN(C)C |
Standard InCHI:   | InChI=1S/C15H24N2O2/c1-4-5-10-16-14-8-6-13(7-9-14)15(18)19-12-11-17(2)3/h6-9,16H,4-5,10-12H2,1-3H3 |
Standard InCHIKey:   | GKCBAIGFKIBETG-UHFFFAOYSA-N |
Max Developmental Stage:   | Approved |
Max Developmental Stage Source:   | ChEMBL |
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
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.
High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7
Similarity Level | Similarity Score | Natural Product ID |
---|---|---|
High Similarity | 0.9416 | NPC319645 |
Intermediate Similarity | 0.8392 | NPC173295 |
Intermediate Similarity | 0.8369 | NPC314098 |
Intermediate Similarity | 0.8224 | NPC314223 |
Intermediate Similarity | 0.8176 | NPC470971 |
Intermediate Similarity | 0.8041 | NPC242933 |
Intermediate Similarity | 0.7867 | NPC43477 |
Intermediate Similarity | 0.7823 | NPC253476 |
Intermediate Similarity | 0.7692 | NPC226794 |
Intermediate Similarity | 0.766 | NPC150323 |
Intermediate Similarity | 0.7603 | NPC122235 |
Intermediate Similarity | 0.7586 | NPC322433 |
Intermediate Similarity | 0.7582 | NPC472241 |
Intermediate Similarity | 0.7517 | NPC205946 |
Intermediate Similarity | 0.7516 | NPC123241 |
Intermediate Similarity | 0.7516 | NPC61013 |
Intermediate Similarity | 0.7469 | NPC193410 |
Intermediate Similarity | 0.7451 | NPC472243 |
Intermediate Similarity | 0.7436 | NPC472242 |
Intermediate Similarity | 0.7434 | NPC287358 |
Intermediate Similarity | 0.7423 | NPC248117 |
Intermediate Similarity | 0.741 | NPC57051 |
Intermediate Similarity | 0.7397 | NPC472244 |
Intermediate Similarity | 0.7397 | NPC470343 |
Intermediate Similarity | 0.7378 | NPC293458 |
Intermediate Similarity | 0.7283 | NPC159963 |
Intermediate Similarity | 0.7251 | NPC186669 |
Intermediate Similarity | 0.7225 | NPC288305 |
Intermediate Similarity | 0.7212 | NPC474058 |
Intermediate Similarity | 0.7202 | NPC167724 |
Intermediate Similarity | 0.7202 | NPC223595 |
Intermediate Similarity | 0.7202 | NPC224970 |
Intermediate Similarity | 0.72 | NPC472245 |
Intermediate Similarity | 0.7197 | NPC308197 |
Intermediate Similarity | 0.7134 | NPC36836 |
Intermediate Similarity | 0.7134 | NPC63370 |
Intermediate Similarity | 0.7119 | NPC14994 |
Intermediate Similarity | 0.7103 | NPC226143 |
Intermediate Similarity | 0.7102 | NPC322621 |
Intermediate Similarity | 0.7095 | NPC25401 |
Intermediate Similarity | 0.7093 | NPC264482 |
Intermediate Similarity | 0.7093 | NPC203202 |
Intermediate Similarity | 0.7079 | NPC316405 |
Intermediate Similarity | 0.7076 | NPC73280 |
Intermediate Similarity | 0.7075 | NPC26285 |
Intermediate Similarity | 0.7063 | NPC478039 |
Intermediate Similarity | 0.7062 | NPC160381 |
Intermediate Similarity | 0.7048 | NPC36495 |
Intermediate Similarity | 0.7044 | NPC314186 |
Intermediate Similarity | 0.7041 | NPC472115 |
Intermediate Similarity | 0.7041 | NPC472114 |
Intermediate Similarity | 0.7037 | NPC473329 |
Intermediate Similarity | 0.7034 | NPC229353 |
Intermediate Similarity | 0.702 | NPC150863 |
Intermediate Similarity | 0.7011 | NPC6974 |
Intermediate Similarity | 0.7011 | NPC218594 |
Intermediate Similarity | 0.7011 | NPC321211 |
Intermediate Similarity | 0.7011 | NPC99043 |
Intermediate Similarity | 0.7 | NPC314278 |
Intermediate Similarity | 0.7 | NPC250476 |
Intermediate Similarity | 0.7 | NPC22476 |
Remote Similarity | 0.6989 | NPC470317 |
Remote Similarity | 0.6987 | NPC281104 |
Remote Similarity | 0.6977 | NPC177261 |
Remote Similarity | 0.6975 | NPC242000 |
Remote Similarity | 0.6974 | NPC280807 |
Remote Similarity | 0.6974 | NPC314431 |
Remote Similarity | 0.6949 | NPC97584 |
Remote Similarity | 0.6949 | NPC471742 |
Remote Similarity | 0.6944 | NPC5630 |
Remote Similarity | 0.6941 | NPC182131 |
Remote Similarity | 0.6939 | NPC130931 |
Remote Similarity | 0.6932 | NPC197335 |
Remote Similarity | 0.6928 | NPC231382 |
Remote Similarity | 0.6923 | NPC189116 |
Remote Similarity | 0.6919 | NPC103361 |
Remote Similarity | 0.6919 | NPC292265 |
Remote Similarity | 0.6906 | NPC203628 |
Remote Similarity | 0.6895 | NPC285192 |
Remote Similarity | 0.6893 | NPC314659 |
Remote Similarity | 0.6872 | NPC87391 |
Remote Similarity | 0.6867 | NPC161827 |
Remote Similarity | 0.6863 | NPC194562 |
Remote Similarity | 0.6848 | NPC303214 |
Remote Similarity | 0.6845 | NPC232600 |
Remote Similarity | 0.6839 | NPC118940 |
Remote Similarity | 0.6839 | NPC329338 |
Remote Similarity | 0.6839 | NPC469726 |
Remote Similarity | 0.6832 | NPC190945 |
Remote Similarity | 0.6828 | NPC123395 |
Remote Similarity | 0.6824 | NPC313757 |
Remote Similarity | 0.6821 | NPC249614 |
Remote Similarity | 0.6816 | NPC49184 |
Remote Similarity | 0.6795 | NPC316104 |
Remote Similarity | 0.6795 | NPC162417 |
Remote Similarity | 0.6793 | NPC135950 |
Remote Similarity | 0.6786 | NPC471197 |
Remote Similarity | 0.6784 | NPC299582 |
Remote Similarity | 0.6782 | NPC285622 |
Remote Similarity | 0.6782 | NPC191310 |
Remote Similarity | 0.6765 | NPC282339 |
Remote Similarity | 0.6765 | NPC99632 |
Remote Similarity | 0.6763 | NPC38262 |
Remote Similarity | 0.6761 | NPC14849 |
Remote Similarity | 0.6758 | NPC313293 |
Remote Similarity | 0.6751 | NPC471198 |
Remote Similarity | 0.6748 | NPC259678 |
Remote Similarity | 0.6746 | NPC97380 |
Remote Similarity | 0.6746 | NPC63210 |
Remote Similarity | 0.6746 | NPC243673 |
Remote Similarity | 0.6746 | NPC310403 |
Remote Similarity | 0.6746 | NPC263709 |
Remote Similarity | 0.6746 | NPC148468 |
Remote Similarity | 0.6744 | NPC214960 |
Remote Similarity | 0.6744 | NPC471652 |
Remote Similarity | 0.6744 | NPC279527 |
Remote Similarity | 0.674 | NPC181928 |
Remote Similarity | 0.6732 | NPC72473 |
Remote Similarity | 0.6732 | NPC307437 |
Remote Similarity | 0.6732 | NPC58827 |
Remote Similarity | 0.6724 | NPC318183 |
Remote Similarity | 0.6723 | NPC131450 |
Remote Similarity | 0.6723 | NPC147298 |
Remote Similarity | 0.6723 | NPC182057 |
Remote Similarity | 0.6711 | NPC179605 |
Remote Similarity | 0.6711 | NPC279385 |
Remote Similarity | 0.6708 | NPC301702 |
Remote Similarity | 0.6707 | NPC315829 |
Remote Similarity | 0.6706 | NPC27904 |
Remote Similarity | 0.6706 | NPC93653 |
Remote Similarity | 0.6705 | NPC84347 |
Remote Similarity | 0.6684 | NPC477979 |
Remote Similarity | 0.6684 | NPC100863 |
Remote Similarity | 0.6667 | NPC253667 |
Remote Similarity | 0.6667 | NPC257763 |
Remote Similarity | 0.6667 | NPC286871 |
Remote Similarity | 0.6667 | NPC83111 |
Remote Similarity | 0.6667 | NPC245916 |
Remote Similarity | 0.6667 | NPC103292 |
Remote Similarity | 0.6667 | NPC176983 |
Remote Similarity | 0.6667 | NPC478075 |
Remote Similarity | 0.6667 | NPC35510 |
Remote Similarity | 0.6667 | NPC471778 |
Remote Similarity | 0.6667 | NPC473298 |
Remote Similarity | 0.665 | NPC36405 |
Remote Similarity | 0.6649 | NPC132539 |
Remote Similarity | 0.6649 | NPC87714 |
Remote Similarity | 0.6648 | NPC248862 |
Remote Similarity | 0.6648 | NPC328611 |
Remote Similarity | 0.6644 | NPC291962 |
Remote Similarity | 0.6644 | NPC177684 |
Remote Similarity | 0.6642 | NPC78701 |
Remote Similarity | 0.6642 | NPC35448 |
Remote Similarity | 0.6632 | NPC329567 |
Remote Similarity | 0.6632 | NPC330683 |
Remote Similarity | 0.663 | NPC138370 |
Remote Similarity | 0.6627 | NPC144691 |
Remote Similarity | 0.6625 | NPC181527 |
Remote Similarity | 0.6615 | NPC195787 |
Remote Similarity | 0.6615 | NPC246140 |
Remote Similarity | 0.6613 | NPC198205 |
Remote Similarity | 0.6613 | NPC21483 |
Remote Similarity | 0.6609 | NPC470894 |
Remote Similarity | 0.6607 | NPC107287 |
Remote Similarity | 0.66 | NPC112373 |
Remote Similarity | 0.66 | NPC161956 |
Remote Similarity | 0.66 | NPC258531 |
Remote Similarity | 0.6597 | NPC207971 |
Remote Similarity | 0.6596 | NPC218733 |
Remote Similarity | 0.6596 | NPC476198 |
Remote Similarity | 0.6596 | NPC132874 |
Remote Similarity | 0.6596 | NPC265642 |
Remote Similarity | 0.6596 | NPC138615 |
Remote Similarity | 0.6594 | NPC146351 |
Remote Similarity | 0.659 | NPC52059 |
Remote Similarity | 0.659 | NPC470069 |
Remote Similarity | 0.6588 | NPC153694 |
Remote Similarity | 0.6588 | NPC211525 |
Remote Similarity | 0.6583 | NPC77777 |
Remote Similarity | 0.6581 | NPC311753 |
Remote Similarity | 0.6576 | NPC45389 |
Remote Similarity | 0.6576 | NPC469489 |
Remote Similarity | 0.6576 | NPC474059 |
Remote Similarity | 0.6571 | NPC472118 |
Remote Similarity | 0.657 | NPC199737 |
Remote Similarity | 0.6569 | NPC249912 |
Remote Similarity | 0.6569 | NPC92754 |
Remote Similarity | 0.6569 | NPC276775 |
Remote Similarity | 0.6564 | NPC478040 |
Remote Similarity | 0.6562 | NPC475147 |
Remote Similarity | 0.6562 | NPC268077 |
Remote Similarity | 0.6557 | NPC21425 |
Remote Similarity | 0.6557 | NPC473815 |
Remote Similarity | 0.6545 | NPC1464 |
Remote Similarity | 0.6543 | NPC471164 |
Remote Similarity | 0.6543 | NPC198390 |
Remote Similarity | 0.6536 | NPC192533 |
Remote Similarity | 0.6533 | NPC312645 |
Remote Similarity | 0.6528 | NPC24777 |
Remote Similarity | 0.6527 | NPC214239 |
Molecular Weight   | 264.18 |
ALogP   | -0.7836 |
MLogP   | 2.67 |
XLogP   | 2.917 |
HDA   | 4 |
HBD   | 1 |
Rotatable Bonds   | 12 |
TPSA   | 41.57 |
RO5 Violation   | 0 |