UCSF

ZINC09597389

Substance Information

In ZINC since Heavy atoms Benign functionality
September 4th, 2007 27 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) 4.05 10.75 -46.72 1 5 1 53 366.437 5
Hi High (pH 8-9.5) 4.05 7.79 -10.82 0 5 0 52 365.429 5

Activity (Go SEA)

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