General Information of the Compound
| Compound ID |
CP0369905
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| Compound Name |
3-[4-[4-(9-amino-5,6,7,8-tetrahydroacridin-2-yl)piperazin-1-yl]butyl]-1H-indole-5-carbonitrile
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| Structure |
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| Formula |
C30H34N6
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| Molecular Weight |
478.644
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| Canonical SMILES |
Nc1c2CCCCc2nc2ccc(cc12)N1CCN(CCCCc2c[nH]c3ccc(cc23)C#N)CC1
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| InChI |
InChI=1S/C30H34N6/c31-19-21-8-10-27-25(17-21)22(20-33-27)5-3-4-12-35-13-15-36(16-14-35)23-9-11-29-26(18-23)30(32)24-6-1-2-7-28(24)34-29/h8-11,17-18,20,33H,1-7,12-16H2,(H2,32,34)
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| InChIKey |
LKUAJBFIWYFDNP-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