Drug Information
| General Information | ||||||
|---|---|---|---|---|---|---|
| Drug ID |
DR01086
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| Drug Name |
(R/S) EF-1500
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| Synonyms |
(R/S) EF-1500; GTPL4583
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| Drug Type |
Small molecular drug
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| Structure |
|
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| 3D MOL | 2D MOL | |||||
| Formula |
C21H24N2O2S2
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| Canonical SMILES |
CC1=C(SC=C1)C(=CCCNC2CCCC3=C2C(=O)NO3)C4=C(C=CS4)C
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| InChI |
InChI=1S/C21H24N2O2S2/c1-13-8-11-26-19(13)15(20-14(2)9-12-27-20)5-4-10-22-16-6-3-7-17-18(16)21(24)23-25-17/h5,8-9,11-12,16,22H,3-4,6-7,10H2,1-2H3,(H,23,24)
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| InChIKey |
TYXWOLAOXRISSO-UHFFFAOYSA-N
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| Pharmaceutical Properties | Molecular Weight | 400.6 | Topological Polar Surface Area | 107 | ||
| Heavy Atom Count | 27 | Rotatable Bond Count | 6 | |||
| Hydrogen Bond Donor Count | 2 | Hydrogen Bond Acceptor Count | 5 | |||
| XLogP |
4.5
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| PubChem CID | ||||||
| PubChem SID | ||||||
| TTD Drug ID | ||||||
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