UCSF

ZINC15924363

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2008 16 No

Other Names:

BRD-K82266581-001-01-8

Download: MOL2 SDF SMILES Flexibase

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) 3.12 7.08 -43.16 1 3 -1 42 234.348 1
Mid Mid (pH 6-8) 3.12 7.08 -20.79 2 3 0 43 235.356 1

Activity (Go SEA)

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