UCSF

ZINC19782386

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2008 21 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) -0.36 3.92 -17.65 0 6 0 61 287.319 2
Ref Reference (pH 7) -0.36 3.94 -17.46 0 6 0 61 287.319 2
Mid Mid (pH 6-8) -0.36 6.3 -56.3 1 6 1 62 288.327 2

Activity (Go SEA)

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