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Chemistry

Mol. Mass

492.53

ALogP

4.28

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: COCCOC(=O)C1=C(C)NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC\C=C\c3ccccc3)C
  • InChIKey: KJEBULYHNRNJTE-DHZHZOJOSA-N
    InChI=1S/C27H28N2O7/c1-18-23(26(30)35-14-8-11-20-9-5-4-6-10-20)25(21-12-7-13-22(17-21)29(32)33)24(19(2)28-18)27(31)36-16-15-34-3/h4-13,17,25,28H,14-16H2,1-3H3/b11-8+
  • Chirality: Racemic Mixture
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL452076   ChEMBL
cilnidipine

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