UCSF

ZINC11992694

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2008 26 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) 0.75 1.81 -20.11 3 10 0 139 361.358 8
Mid Mid (pH 6-8) 1.20 0.23 -46.35 2 10 -1 142 360.35 8

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.