UCSF

ZINC04247266

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 19 No

Popular Name: 2-benzothiazol-2-yl-3-phenyl-prop-2-enenitrile 2-benzothiazol-2-yl-3-phenyl-pro…

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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) 3.95 1.14 -12.31 0 2 0 36 262.337 2 ↓

Vendor Notes

Note Type Comments Provided By
mp 105 MolMall (formerly Molecular Diversity Preservation International)

Activity (Go SEA)

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