UCSF

ZINC35024808

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 16 Yes

Popular Name: (R)-Benzyl 2-amino-4-methylpentanoate 4-methylbenzenesulfonate (R)-Benzyl 2-amino-4-methylpenta…

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CAS Numbers: 1738-77-8 , 17664-93-6 , 200123-51-9 , 68838-94-8 , [17664-93-6]

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) 2.29 6.02 -5.23 2 3 0 52 221.3 6 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 153-160? Alfa-Aesar
MP 158 TCI
Purity 95% Fluorochem
Purity 98% min APIChem

Activity (Go SEA)

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