UCSF

ZINC20935843

Substance Information

In ZINC since Heavy atoms Benign functionality
November 30th, 2008 23 No

Download: MOL2 SDF SMILES Flexibase

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) 1.42 7.04 -48.08 2 6 1 67 338.453 6
Hi High (pH 8-9.5) 1.42 5.04 -12.72 1 6 0 66 337.445 6

Activity (Go SEA)

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