UCSF

ZINC36915726

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 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) -1.75 -1.63 -67.83 3 6 1 101 248.328 6
Hi High (pH 8-9.5) -1.75 -1.92 -16.65 2 6 0 99 247.32 6

Activity (Go SEA)

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