UCSF

ZINC00388579

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2005 9 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 0.72 2.41 -29.05 1 3 1 23 134.199 3

Vendor Notes

Note Type Comments Provided By
Boiling_Point 118-120? Alfa-Aesar
Boiling_Point 118-120° Alfa-Aesar

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.