UCSF

ZINC37372277

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 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) -0.37 0.36 -42.18 4 7 1 99 282.32 6
Hi High (pH 8-9.5) -0.37 -1.07 -10.09 3 7 0 95 281.312 6

Activity (Go SEA)

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