UCSF

ZINC38021975

Substance Information

In ZINC since Heavy atoms Benign functionality
December 21st, 2009 16 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) -1.66 4.64 -36.22 1 6 0 82 228.248 5
Hi High (pH 8-9.5) -1.65 2.32 -40.32 0 6 -1 81 227.24 5

Activity (Go SEA)

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