Molecular Properties | |
SMILES: | O=C(C1CCN(c2ncnc3c2sc2ncccc23)CC1)N1CCC(Cc2ccccc2)CC1 |
MW: | 471.21 |
Fraction sp3: | 0.41 |
HBA: | 6 |
HBD: | 0 |
Rotatable Bonds: | 4 |
TPSA: | 62.22 |
cLogP: | 4.94 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-3061399144 |
MolPort: | MolPort-007-799-916 |
AAR-POS-fca48359-5
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AAR-POS-fca48359-4
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DRA-CSI-47e38074-13
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MAR-TRE-f6f5f473-48
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NIC-BIO-f814dd3d-1
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MIC-SGC-657978c3-1
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MAR-SOS-82e3a7c7-7
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MAR-SOS-c7881798-8
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MAR-TRE-b77b7921-46
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SIM-DEM-1d7050d3-1
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MAT-POS-b5746674-15
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MIC-SGC-657978c3-5
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ALP-POS-e980f4ea-31
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DAR-DIA-6a49afbe-4
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