UCSF

ZINC14805387

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2008 32 No

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 2.35 3.6 -19.3 4 9 0 133 492.966 8
Hi High (pH 8-9.5) 2.35 3.64 -54.06 3 9 -1 136 491.958 8

Activity (Go SEA)

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

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