UCSF

ZINC06091210

Substance Information

In ZINC since Heavy atoms Benign functionality
March 5th, 2006 16 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 1.15 3.3 -11.87 1 4 0 58 260.076 1
Mid Mid (pH 6-8) 1.15 4.06 -47.51 0 4 -1 60 259.068 1

Activity (Go SEA)

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