UCSF

ZINC37809626

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 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) -2.91 -5.61 -69.75 4 8 1 136 343.447 7
Hi High (pH 8-9.5) -2.91 -5.94 -27.51 3 8 0 135 342.439 7

Activity (Go SEA)

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