UCSF

ZINC35208090

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2009 18 No

Download: MOL2 SDF SMILES Flexibase

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) -0.35 1.34 -7.38 1 6 0 65 252.318 2
Mid Mid (pH 6-8) -0.35 3.51 -41.53 2 6 1 66 253.326 2

Activity (Go SEA)

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