UCSF

ZINC25783465

Substance Information

In ZINC since Heavy atoms Benign functionality
February 1st, 2009 35 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) 3.52 10.1 -30.28 4 11 1 142 474.549 6
Hi High (pH 8-9.5) 3.52 7.86 -11.59 3 11 0 140 473.541 6

Activity (Go SEA)

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