Molecular Properties | |
SMILES: | N#CCN1CC(C(=O)Nc2cncc3cc(Cl)ccc23)c2cc(Cl)ccc2C1=O |
MW: | 424.05 |
Fraction sp3: | 0.14 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 86.09 |
cLogP: | 4.24 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
N-C-Hal or cyano methyl
cyanamide
PET-UNK-c671f938-6
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PET-UNK-c671f938-1
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PET-UNK-c671f938-5
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EDJ-MED-41558c53-9
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PET-UNK-c671f938-7
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PET-UNK-c671f938-4
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PET-UNK-c671f938-8
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PET-UNK-4d432d33-2
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PET-UNK-4d432d33-6
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EDJ-MED-41558c53-11
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LUO-POS-edefcc0e-1
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LUO-POS-74179f4f-1
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EDJ-MED-41558c53-13
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PET-UNK-3324058f-2
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PET-UNK-3324058f-6
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PET-UNK-4d432d33-1
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PET-UNK-4d432d33-5
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EDJ-MED-41558c53-1
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EDJ-MED-41558c53-10
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EDJ-MED-0186a59b-5
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PET-UNK-f860268d-2
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EDJ-MED-eb111c00-3
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EDJ-MED-0186a59b-7
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EDJ-MED-e69ed63d-11
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MIC-UNK-482af05e-3
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PET-UNK-3324058f-1
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EDJ-MED-e69ed63d-16
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EDJ-MED-e69ed63d-2
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LUO-POS-868e8996-3
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LUO-POS-868e8996-4
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ALP-POS-b3e0acc5-1
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RAL-THA-a9c31980-1
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EDJ-MED-d165ed91-3
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PET-UNK-c7ac4d9e-1
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PET-UNK-c7ac4d9e-2
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PET-UNK-3324058f-4
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PET-UNK-3324058f-8
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RAL-THA-a9c31980-8
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EDJ-MED-41558c53-6
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RAL-THA-a9c31980-6
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EDJ-MED-c99b2211-2
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JOH-UNI-6b98e24c-1
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RAL-THA-a9c31980-3
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PET-UNK-37251634-12
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PET-UNK-37251634-3
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PET-UNK-37251634-4
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PET-UNK-37251634-11
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EDJ-MED-cc48ee33-6
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