UCSF

ZINC37840653

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 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) -1.36 -3.68 -17.32 3 9 0 124 299.312 2
Hi High (pH 8-9.5) -1.18 -6.31 -49.9 2 9 -1 131 298.304 2

Activity (Go SEA)

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