UCSF

ZINC35366878

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2009 21 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) -0.34 2.68 -31.79 5 6 1 94 291.375 6
Hi High (pH 8-9.5) -0.34 0.48 -9.65 4 6 0 93 290.367 6

Activity (Go SEA)

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