UCSF

ZINC20154655

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2008 20 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) 3.04 4.12 -30.4 4 4 0 71 301.396 3
Hi High (pH 8-9.5) 3.04 4.91 -68.92 3 4 -1 74 300.388 3

Activity (Go SEA)

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