General Information of the Compound
| Compound ID |
CP0880187
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| Compound Name |
SID131404677
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| Structure |
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| Formula |
C23H19ClN2O2S
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| Molecular Weight |
422.937
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| Canonical SMILES |
O=C(CCc1ccccc1)NC(c1cccs1)c1cc(Cl)c2cccnc2c1O
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| InChI |
InChI=1S/C23H19ClN2O2S/c24-18-14-17(23(28)22-16(18)8-4-12-25-22)21(19-9-5-13-29-19)26-20(27)11-10-15-6-2-1-3-7-15/h1-9,12-14,21,28H,10-11H2,(H,26,27)
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| InChIKey |
SRLJNSQTNHJWPA-UHFFFAOYSA-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
Protein ID: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06101, Latent membrane protein 1