UCSF

ZINC15454170

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2008 21 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) -1.53 6.83 -31.69 1 4 1 32 353.284 3
Mid Mid (pH 6-8) -1.53 9.36 -105.54 2 4 2 34 354.292 3

Activity (Go SEA)

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