UCSF

ZINC24080614

Substance Information

In ZINC since Heavy atoms Benign functionality
January 13th, 2009 34 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) 5.15 14.16 -67.36 1 6 0 74 485.024 11
Hi High (pH 8-9.5) 5.15 11.94 -54.88 0 6 -1 73 484.016 11

Activity (Go SEA)

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