UCSF

ZINC35384941

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2009 16 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) -1.66 2.94 -42.55 3 6 0 103 230.264 7
Hi High (pH 8-9.5) -1.66 2.08 -53.32 2 6 -1 98 229.256 7

Activity (Go SEA)

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