UCSF

ZINC08926900

Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2007 34 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) 2.31 6.76 -52.32 3 8 1 101 467.542 8
Mid Mid (pH 6-8) 1.73 7.43 -61.59 2 8 1 98 467.542 8

Activity (Go SEA)

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