UCSF

ZINC08084734

Substance Information

In ZINC since Heavy atoms Benign functionality
June 30th, 2006 26 No

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) 3.72 8.09 -25.97 1 6 0 89 370.43 4
Mid Mid (pH 6-8) 3.72 8.31 -68.99 0 6 -1 91 369.422 4

Activity (Go SEA)

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