UCSF

ZINC16676535

Substance Information

In ZINC since Heavy atoms Benign functionality
September 4th, 2008 32 Yes

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) 1.49 -0.23 -23.55 1 10 0 122 489.616 7
Mid Mid (pH 6-8) 1.49 1.9 -51.05 2 10 1 124 490.624 7

Activity (Go SEA)

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