UCSF

ZINC09209543

Substance Information

In ZINC since Heavy atoms Benign functionality
August 14th, 2007 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) 5.12 14.97 -20.02 0 8 0 96 465.465 4
Ref Reference (pH 7) 5.12 14.98 -17.17 0 8 0 96 465.465 4

Activity (Go SEA)

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