General Information of the Compound
| Compound ID |
CP0234730
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| Compound Name |
1-(2-methyl-1,3-benzoxazol-5-yl)-3-[(1S,2R)-2-phenylcyclopropyl]urea
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| Structure |
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| Formula |
C18H17N3O2
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| Molecular Weight |
307.353
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| Canonical SMILES |
Cc1nc2cc(NC(=O)N[C@H]3C[C@@H]3c3ccccc3)ccc2o1
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| InChI |
InChI=1S/C18H17N3O2/c1-11-19-16-9-13(7-8-17(16)23-11)20-18(22)21-15-10-14(15)12-5-3-2-4-6-12/h2-9,14-15H,10H2,1H3,(H2,20,21,22)/t14-,15+/m1/s1
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| InChIKey |
HVLSJQKDRGRVML-CABCVRRESA-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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