UCSF

ZINC08433391

Substance Information

In ZINC since Heavy atoms Benign functionality
July 14th, 2006 43 No

Other Names:

MFCD03287632

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) 6.44 2.26 -58.3 2 7 1 80 577.701 12
Mid Mid (pH 6-8) 5.85 2.16 -69.25 1 7 1 77 577.701 12

Activity (Go SEA)

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