UCSF

ZINC25803775

Substance Information

In ZINC since Heavy atoms Benign functionality
February 1st, 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) 3.74 10.34 -41.74 2 4 1 37 342.438 3
Hi High (pH 8-9.5) 3.74 7.98 -7.66 1 4 0 36 341.43 3

Activity (Go SEA)

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