UCSF

ZINC16983201

Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2008 19 Yes

Other Names:

F2147-0526

MFCD09463151

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) -0.71 3.92 -15.96 1 8 0 103 265.225 2
Mid Mid (pH 6-8) -0.25 3.14 -35.26 0 8 -1 106 264.217 2

Activity (Go SEA)

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