General Information of the Compound
| Compound ID |
CP0232487
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| Compound Name |
(3aR,4S,5S,6aR)-5-amino-4-(3-boronopropyl)-2,3,3a,4,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-5-carboxylic acid
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| Structure |
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| Formula |
C11H21BN2O4
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| Molecular Weight |
256.111
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| Canonical SMILES |
N[C@]1(C[C@H]2CNC[C@H]2[C@@H]1CCCB(O)O)C(O)=O
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| InChI |
InChI=1S/C11H21BN2O4/c13-11(10(15)16)4-7-5-14-6-8(7)9(11)2-1-3-12(17)18/h7-9,14,17-18H,1-6,13H2,(H,15,16)/t7-,8+,9-,11-/m0/s1
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| InChIKey |
XIEAQQGNISCWOO-DKIAZLNASA-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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