UCSF

ZINC39952159

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 19th, 2010 15 Yes

Popular Name: Benzyl (2-aminoethyl)(methyl)carbamate hydrochloride Benzyl (2-aminoethyl)(methyl)car…

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CAS Numbers: 162576-01-4 , 19023-94-0 , [162576-01-4]

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) 0.59 3.85 -47.04 3 4 1 57 209.269 5 ↓
Hi High (pH 8-9.5) 0.59 3.46 -6.66 2 4 0 56 208.261 5 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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