UCSF

ZINC34597822

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 17 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) 3.01 8.07 -5.19 0 2 0 34 226.275 0
Ref Reference (pH 7) 3.01 8.08 -5.19 0 2 0 34 226.275 0
Ref Reference (pH 7) 3.01 7.87 -6.04 0 2 0 34 226.275 0
Ref Reference (pH 7) 3.01 7.87 -6.11 0 2 0 34 226.275 0

Activity (Go SEA)

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