abp-700 Report issue

Small molecule Experimental
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Chemistry

Mol. Mass

314.34

ALogP

2.35

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: COC(=O)C1(OC(=O)c2cncn2[C@H](C)c2ccccc2)CC1
  • InChIKey: DRAFVCKNYNQOKR-GFCCVEGCSA-N
    InChI=1S/C17H18N2O4/c1-12(13-6-4-3-5-7-13)19-11-18-10-14(19)15(20)23-17(8-9-17)16(21)22-2/h3-7,10-12H,8-9H2,1-2H3/t12-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4297255   ChEMBL
abp-700

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