UCSF

ZINC08441899

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2006 32 No

Other Names:

MFCD02950165

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) 3.59 2.98 -61.66 2 7 1 118 432.548 6
Mid Mid (pH 6-8) 3.59 2.81 -118.19 3 7 2 119 433.556 6

Activity (Go SEA)

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