UCSF

ZINC19769971

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2008 12 Yes

Popular Name: 6-Chloro-2-methyl-3,4-dihydro-2H-1,4-benzoxazine 6-Chloro-2-methyl-3,4-dihydro-2H…

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CAS Numbers: 1082837-97-5 , [1082837-97-5]

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) 2.68 3.77 -5.04 1 2 0 21 183.638 0 ↓

Vendor Notes

Note Type Comments Provided By
MP 75 - 77 Enamine Building Blocks
MP 75...77 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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