UCSF

ZINC34034355

Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2009 27 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) -1.56 -1.27 -28.05 5 10 0 150 376.417 6
Mid Mid (pH 6-8) -1.56 -0.78 -54.48 6 10 1 152 377.425 6
Mid Mid (pH 6-8) -1.56 -0.1 -25.09 5 10 0 150 376.417 6

Activity (Go SEA)

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