UCSF

ZINC04012912

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2005 25 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 0.31 -1.29 -59.52 7 10 1 157 351.339 5
Hi High (pH 8-9.5) 0.77 -1.83 -57.78 6 10 0 160 350.331 5

Activity (Go SEA)

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