UCSF

ZINC34732642

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 24th, 2009 10 Yes

Popular Name: Methyl morpholine-2-carboxylate hydrochloride Methyl morpholine-2-carboxylate …

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1314999-01-3 , 1314999-04-6 , 1352709-55-7 , 135782-19-3 , 1373253-22-5 , 937063-34-8 , [1314999-04-6] , [1373253-22-5] , [937063-34-8]

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) -0.56 1.51 -48.26 2 4 1 52 146.166 2 ↓
Hi High (pH 8-9.5) 2.71 7.48 -32.27 5 6 1 93 455.582 5 ↓
Mid Mid (pH 6-8) -0.56 0.14 -7.62 1 4 0 48 145.158 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 155 - 157 Enamine Building Blocks
MP 155...157 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 97% Fluorochem
Warnings IRRITANT Matrix Scientific

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