UCSF

ZINC07613149

Substance Information

In ZINC since Heavy atoms Benign functionality
June 7th, 2006 17 No

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) -1.54 -0.95 -25.42 0 2 1 3 255.744 2
Mid Mid (pH 6-8) -1.54 2.38 -98.35 1 2 2 4 256.752 2

Activity (Go SEA)

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