General Information of the Compound
| Compound ID |
CP0935289
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| Compound Name |
SID144199866
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| Structure |
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| Formula |
C34H39N3O5
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| Molecular Weight |
569.702
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| Canonical SMILES |
Cc1ccc(OC(=O)N(C)C[C@@H]2OCc3ccccc3-c3c(n(C)c4ccccc34)C(=O)N([C@@H](C)CO)C[C@H]2C)cc1
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| InChI |
InChI=1S/C34H39N3O5/c1-22-14-16-26(17-15-22)42-34(40)35(4)19-30-23(2)18-37(24(3)20-38)33(39)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)36(32)5/h6-17,23-24,30,38H,18-21H2,1-5H3/t23-,24+,30+/m1/s1
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| InChIKey |
QTCNHWMCPMTVQP-QEGDFHJFSA-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