UCSF

ZINC39872107

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 36 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 4.73 12.51 -13.98 0 8 0 95 485.492 7

Activity (Go SEA)

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