UCSF

ZINC26356857

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2009 24 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) 1.33 6.21 -52.01 4 6 1 80 333.456 7
Hi High (pH 8-9.5) 1.33 4.38 -18.29 3 6 0 79 332.448 7

Activity (Go SEA)

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