UCSF

ZINC07613163

Substance Information

In ZINC since Heavy atoms Benign functionality
June 7th, 2006 20 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) -2.70 -3.68 -36.17 1 4 1 32 294.806 4
Mid Mid (pH 6-8) -2.70 -0.34 -108.04 2 4 2 33 295.814 4

Activity (Go SEA)

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