UCSF

ZINC65535461

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 16 No

Other Names:

MFCD01247014

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) 0.60 4.96 -36.68 3 4 1 58 259.424 3
Mid Mid (pH 6-8) 0.60 4.72 -31 2 4 0 56 258.416 3

Activity (Go SEA)

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

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