UCSF

ZINC02641187

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2004 12 Yes

Other Names:

MFCD02187165

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) 0.49 8.53 -6.82 0 4 0 36 162.196 1

Vendor Notes

Note Type Comments Provided By
melting_point 150 - 152 KeyOrganics

Activity (Go SEA)

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

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