UCSF

ZINC03734910

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 15 Yes

Popular Name: 2-(3-methoxyphenyl)azepane 2-(3-methoxyphenyl)azepane

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CAS Numbers: 383129-37-1 , [383129-37-1]

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) 2.22 -0.12 -37.17 2 2 1 26 206.309 2 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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