UCSF

ZINC36138960

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 12 Yes

Popular Name: Ethyl 2-(aminomethyl)thiazole-4-carboxylate Ethyl 2-(aminomethyl)thiazole-4-…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1306603-28-0 , 91711-96-5 , [91711-96-5]

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) 0.23 1.04 -53.55 3 4 1 67 187.244 4 ↓
Mid Mid (pH 6-8) 0.23 0.64 -9.81 2 4 0 65 186.236 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 128 - 130 Enamine Building Blocks
MP 128...130 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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