Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LB4N9D
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| Ligand Name |
1-[4-[4-(aminomethyl)pyrazol-1-yl]-3-chloranyl-phenyl]-3-[(3~{R})-6-bromanyl-3,4-dihydro-2~{H}-chromen-3-yl]urea
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| Synonyms |
1-[4-[4-(aminomethyl)pyrazol-1-yl]-3-chloranyl-phenyl]-3-[(3~{R})-6-bromanyl-3,4-dihydro-2~{H}-chromen-3-yl]urea; RJK
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| Structure |
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Download2D MOL |
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| Formula |
C20H19BrClN5O2
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| Canonical SMILES |
C1C(COC2=C1C=C(C=C2)Br)NC(=O)NC3=CC(=C(C=C3)N4C=C(C=N4)CN)Cl
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| InChI |
1S/C20H19BrClN5O2/c21-14-1-4-19-13(5-14)6-16(11-29-19)26-20(28)25-15-2-3-18(17(22)7-15)27-10-12(8-23)9-24-27/h1-5,7,9-10,16H,6,8,11,23H2,(H2,25,26,28)/t16-/m1/s1
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| InChIKey |
DHIWXRKMNHPISE-MRXNPFEDSA-N
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| PubChem Compound ID | ||||
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