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Chemistry

Mol. Mass

341.4009

ALogP

1.53

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: OC1=C2O[C@H]3C(=O)CC[C@@]4(O)[C@H]5CC(C=C1)=C2[C@@]34CCN5CC6CC6
  • InChIKey: DQCKKXVULJGBQN-XFWGSAIBSA-N
    1S/C20H23NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,15,18,22,24H,1-2,5-10H2/t15-,18+,19+,20-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1201149   ChEMBL
naltrexone hydrochloride

CHEMBL19019   ChEMBL
naltrexone

CHEMBL3244648   ChEMBL
methotrexate sodium

CHEMBL34259   ChEMBL
methotrexate

5S6W795CQM   NCATS
naltrexone *

Naltrexone   Wikipedia

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