UCSF

ZINC06375145

Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2006 23 Yes

Other Names:

MFCD00632327

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) 5.60 10.87 -8.88 0 2 0 16 298.389 2
Mid Mid (pH 6-8) 5.60 11.24 -22.53 1 2 1 17 299.397 2

Activity (Go SEA)

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