UCSF

ZINC18247197

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2008 28 No

Other Names:

MFCD02020245

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) 5.38 12.69 -10.59 0 5 0 64 442.309 4
Ref Reference (pH 7) 5.38 12.66 -9.12 0 5 0 64 442.309 4

Activity (Go SEA)

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

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