UCSF

ZINC65735215

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2011 26 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) -0.38 2.27 -33.53 4 10 0 147 395.422 3
Hi High (pH 8-9.5) -0.38 3.54 -83.79 3 10 -1 150 394.414 3

Activity (Go SEA)

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