UCSF

ZINC26420593

Substance Information

In ZINC since Heavy atoms Benign functionality
February 6th, 2009 19 Yes

Other Names:

MFCD14540254

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) 3.04 7.87 -28.07 3 4 1 54 254.313 2
Mid Mid (pH 6-8) 3.04 7.45 -12.67 2 4 0 53 253.305 2

Activity (Go SEA)

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