UCSF

ZINC66322058

Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2011 5 No

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) 1.72 3.14 -1.42 0 0 0 0 114.934 0

Vendor Notes

Note Type Comments Provided By
BP 35° Matrix Scientific
Purity 98% Matrix Scientific
Warnings FLAMMABLE Matrix Scientific

Activity (Go SEA)

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

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