General Information of the Compound
| Compound ID |
CP0537435
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| Compound Name |
cyclopentyl-[4-[2-(dimethylamino)-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]piperazin-1-yl]methanone
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| Structure |
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| Formula |
C28H42N6O3
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| Molecular Weight |
510.683
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| Canonical SMILES |
COc1cc2c(nc(nc2cc1OCCCN1CCCC1)N(C)C)N1CCN(CC1)C(=O)C1CCCC1
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| InChI |
InChI=1S/C28H42N6O3/c1-31(2)28-29-23-20-25(37-18-8-13-32-11-6-7-12-32)24(36-3)19-22(23)26(30-28)33-14-16-34(17-15-33)27(35)21-9-4-5-10-21/h19-21H,4-18H2,1-3H3
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| InChIKey |
MFAAFKAELXSNAX-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