UCSF

ZINC04170874

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 25 No

Other Names:

MFCD02944527

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) -0.25 -2.74 -14.51 2 10 0 119 343.347 5
Mid Mid (pH 6-8) -0.25 -2.45 -38.59 3 10 1 120 344.355 5

Activity (Go SEA)

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