UCSF

ZINC01805051

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 14 No

Popular Name: 6-butyl-1,3-benzothiazol-2-amine 6-butyl-1,3-benzothiazol-2-amine

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CAS Number: 65948-20-1

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) 3.82 -1.71 -6.69 2 2 0 38 206.314 3 ↓
Lo Low (pH 4.5-6) 3.82 -1.65 -27.04 3 2 1 40 207.322 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 100 - 102 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks
MP 94 - 96 Enamine Building Blocks
MP 94...96 Enamine Building Blocks
purity 95 Enamine Building Blocks
MP 95 - 101 Enamine Building Blocks
Purity 95% Fluorochem

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