UCSF

ZINC34833260

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 16 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) 2.40 5.22 -29.09 2 3 1 35 244.742 7
Hi High (pH 8-9.5) 2.40 3.85 -5.16 1 3 0 30 243.734 7

Activity (Go SEA)

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