vallestril Report issue

Small molecule Experimental
ChEMBL Drug Central PubChem

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Chemistry

Mol. Mass

286.3655

ALogP

4.45

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCC(C1=CC=C2C=C(OC)C=CC2=C1)C(C)(C)C(O)=O
  • InChIKey: KHLJKRBMZVNZOC-UHFFFAOYSA-N
    1S/C18H22O3/c1-5-16(18(2,3)17(19)20)14-7-6-13-11-15(21-4)9-8-12(13)10-14/h6-11,16H,5H2,1-4H3,(H,19,20)
  • Chirality: Racemic Mixture
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1697842   ChEMBL
methallenestril

XL025389JS   NCATS
methallenestril *

Methallenestril   Wikipedia

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