UCSF

ZINC00403976

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 15 Yes

Popular Name: (S)-Benzyl (1-hydroxypropan-2-yl)carbamate (S)-Benzyl (1-hydroxypropan-2-yl…

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CAS Numbers: 61425-27-2 , 66674-16-6 , [66674-16-6]

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) 3.04 -2.92 -7.69 2 4 0 58 209.245 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 78-80o C Indofine
MP 81-84 °C(lit.) Indofine
Purity 95% Fluorochem

Activity (Go SEA)

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