UCSF

ZINC26547452

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 25 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) 2.07 5.08 -18.29 1 6 0 76 360.435 5
Hi High (pH 8-9.5) 2.07 5.3 -56.89 0 6 -1 78 359.427 5

Activity (Go SEA)

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