UCSF

ZINC16679654

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) 1.54 3.39 -51.43 2 10 1 127 486.592 10
Hi High (pH 8-9.5) 1.54 2.93 -51.23 1 10 0 130 485.584 10

Activity (Go SEA)

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