General Information of the Compound
| Compound ID |
CP0726102
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| Compound Name |
(R)-2-Amino-N-(3-methoxy-4-(1H-pyrazol-4-yl)phenyl)-4-methylpentanamide
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| Structure |
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| Formula |
C16H22N4O2
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| Molecular Weight |
302.378
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| Canonical SMILES |
COc1cc(NC(=O)[C@H](N)CC(C)C)ccc1-c1cn[nH]c1
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| InChI |
InChI=1S/C16H22N4O2/c1-10(2)6-14(17)16(21)20-12-4-5-13(15(7-12)22-3)11-8-18-19-9-11/h4-5,7-10,14H,6,17H2,1-3H3,(H,18,19)(H,20,21)/t14-/m1/s1
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| InChIKey |
GQJOTHMTVTVJDE-CQSZACIVSA-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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