UCSF

ZINC01847442

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 5 Yes

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) 1.70 3.12 -2.76 0 0 0 0 80.077 0

Vendor Notes

Note Type Comments Provided By
BP Matrix Scientific
Purity 97% Matrix Scientific
Warnings Flammable Gas/Store in Freezer Matrix Scientific
Warnings GAS, FLAMMABLE Matrix Scientific

Activity (Go SEA)

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

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