UCSF

ZINC33831307

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 32 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) -0.07 -7.93 -17.9 7 11 0 190 448.38 4
Hi High (pH 8-9.5) -0.07 -7.17 -55.79 6 11 -1 193 447.372 4

Activity (Go SEA)

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