UCSF

ZINC37818309

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 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) 0.02 -1.23 -49.2 5 7 1 106 283.352 3
Hi High (pH 8-9.5) 0.21 -3.88 -68.85 4 7 0 112 282.344 3

Activity (Go SEA)

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