General Information of the Compound
| Compound ID |
CP0897201
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| Compound Name |
5-(4-Carboxyphenyl)-10,15,20-tri(4-dimethylaminophenyl)porphyrin
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| Structure |
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| Formula |
C51H45N7O2
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| Molecular Weight |
787.968
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| Canonical SMILES |
CN(C)c1ccc(-c2c3nc(c(-c4ccc(N(C)C)cc4)c4ccc([nH]4)c(-c4ccc(N(C)C)cc4)c4nc(c(-c5ccc(C(=O)O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1
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| InChI |
InChI=1S/C51H45N7O2/c1-56(2)36-17-11-32(12-18-36)48-41-25-23-39(52-41)47(31-7-9-35(10-8-31)51(59)60)40-24-26-42(53-40)49(33-13-19-37(20-14-33)57(3)4)44-28-30-46(55-44)50(45-29-27-43(48)54-45)34-15-21-38(22-16-34)58(5)6/h7-30,52,55H,1-6H3,(H,59,60)
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| InChIKey |
DJURTQLBGDVBOL-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