Drug Name |
Z 944
|
Synonyms |
Z-944 |
Indication |
Disease Entry |
ICD 11 |
Status |
REF |
Discovery agent |
N.A.
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Investigative |
[1] |
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Structure |
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 |
3D MOL
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2D MOL
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#Ro5 Violations (Lipinski): 0 |
Molecular Weight (mw) |
383.9 |
|
Logarithm of the Partition Coefficient (xlogp) |
3 |
Rotatable Bond Count (rotbonds) |
6 |
Hydrogen Bond Donor Count (hbonddonor) |
2 |
Hydrogen Bond Acceptor Count (hbondacc) |
4 |
Chemical Identifiers |
- Formula
- C19H27ClFN3O2
- IUPAC Name
N-[[1-[2-(tert-butylamino)-2-oxoethyl]piperidin-4-yl]methyl]-3-chloro-5-fluorobenzamide
- Canonical SMILES
-
CC(C)(C)NC(=O)CN1CCC(CC1)CNC(=O)C2=CC(=CC(=C2)Cl)F
- InChI
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InChI=1S/C19H27ClFN3O2/c1-19(2,3)23-17(25)12-24-6-4-13(5-7-24)11-22-18(26)14-8-15(20)10-16(21)9-14/h8-10,13H,4-7,11-12H2,1-3H3,(H,22,26)(H,23,25)
- InChIKey
-
JOCLITFYIMJMNK-UHFFFAOYSA-N
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Cross-matching ID |
- PubChem CID
- 44540045
- CAS Number
-
- TTD ID
- D0T6NE
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