UCSF

ZINC03888718

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 14 No

Popular Name: 4-(trifluoromethyl)-1,3-benzothiazol-2-amine 4-(trifluoromethyl)-1,3-benzothi…

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CAS Number: 60388-36-5

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) 2.83 -0.24 -9.2 2 2 0 39 218.203 1 ↓
Lo Low (pH 4.5-6) 2.83 -0.11 -28.44 3 2 1 40 219.211 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 149 - 151 Enamine Building Blocks
MP 48 - 50 Enamine Building Blocks
MP 48...50 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% )