General Information of the Compound
| Compound ID |
CP0683529
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| Compound Name |
SID90341760
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| Structure |
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| Formula |
C30H38FN3O2
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| Molecular Weight |
491.651
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| Canonical SMILES |
CC(C)c1cc(F)cc2c1C[C@](CCN(C)CCCc1nc3ccccc3[nH]1)(OC(=O)C1CC1)CC2
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| InChI |
InChI=1S/C30H38FN3O2/c1-20(2)24-18-23(31)17-22-12-13-30(19-25(22)24,36-29(35)21-10-11-21)14-16-34(3)15-6-9-28-32-26-7-4-5-8-27(26)33-28/h4-5,7-8,17-18,20-21H,6,9-16,19H2,1-3H3,(H,32,33)/t30-/m0/s1
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| InChIKey |
SYLIICYFBKGBKE-PMERELPUSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound