UCSF

ZINC00161956

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 12 Yes

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 0.96 2.88 -47.97 1 3 -1 60 165.168 2

Vendor Notes

Note Type Comments Provided By
Melting_Point 115-117? Alfa-Aesar
Melting_Point 115-117° Alfa-Aesar
Melting_Point 87-91? Alfa-Aesar
Melting_Point 87-91° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks
MP 90 - 92 Enamine Building Blocks
MP 90...92 Enamine Building Blocks
MP 91 TCI
purity 95 Enamine Building Blocks

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