UCSF

ZINC17987298

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2008 30 No

Other Names:

MFCD03165375

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) 3.96 11.37 -15.78 0 6 0 73 407.466 6
Ref Reference (pH 7) 3.96 11.13 -14.56 0 6 0 73 407.466 6

Activity (Go SEA)

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

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