UCSF

ZINC34885338

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2009 25 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) -1.55 -2.16 -70.33 8 10 1 156 369.427 6
Hi High (pH 8-9.5) -0.83 -2.57 -87.32 7 10 0 153 368.419 6

Activity (Go SEA)

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