UCSF

ZINC03623896

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 17 Yes

Popular Name: N-(4-methylphenyl)-1,3-benzothiazol-2-amine N-(4-methylphenyl)-1,3-benzothia…

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CAS Number: 70785-26-1

Other Names:

MFCD01830676

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) 4.93 8.92 -7.64 1 2 0 25 240.331 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
PUBCHEM_PATENT_ID EP0805796A1; WO1996022966A1 IBM Patent Data

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