UCSF

ZINC08433428

Substance Information

In ZINC since Heavy atoms Benign functionality
July 14th, 2006 39 No

Other Names:

MFCD03696129

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) 5.31 1.42 -54.61 2 7 1 80 533.689 11
Mid Mid (pH 6-8) 4.72 1.32 -65.96 1 7 1 77 533.689 11

Activity (Go SEA)

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