UCSF

ZINC12137815

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 27th, 2008 17 Yes

Popular Name: 3-[(2,3-Dihydro-1H-inden-5-yloxy)methyl]piperidinehydrochloride 3-[(2,3-Dihydro-1H-inden-5-yloxy…

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CAS Numbers: 1050509-49-3 , 883522-30-3

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.62 -1.12 -37.96 2 2 1 26 232.347 3 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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Analogs ( Draw Identity 99% 90% 80% 70% )