UCSF

ZINC07606159

Substance Information

In ZINC since Heavy atoms Benign functionality
June 7th, 2006 26 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 2.03 9.22 -54 1 5 1 45 376.477 5
Mid Mid (pH 6-8) 2.03 6.98 -16.98 0 5 0 44 375.469 5

Activity (Go SEA)

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