UCSF

ZINC36162695

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 19 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) -1.69 1.85 -56.06 3 5 1 82 283.373 3
Hi High (pH 8-9.5) -1.69 1.52 -15.19 2 5 0 80 282.365 3

Activity (Go SEA)

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