UCSF

ZINC06148604

Substance Information

In ZINC since Heavy atoms Benign functionality
March 8th, 2006 38 No

Other Names:

MFCD02224227

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) 6.71 1.64 -11.1 0 6 0 74 519.613 7
Mid Mid (pH 6-8) 6.89 1.71 -13.02 0 6 0 74 519.613 7

Activity (Go SEA)

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