UCSF

ZINC09232515

Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2007 38 No

Other Names:

MFCD03509249

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.90 9.66 -59.52 2 10 1 112 523.562 8
Mid Mid (pH 6-8) 1.87 10.37 -58.7 1 10 1 109 523.562 9

Activity (Go SEA)

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