UCSF

ZINC08859655

Substance Information

In ZINC since Heavy atoms Benign functionality
July 30th, 2007 34 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) 4.15 10.27 -46.92 2 7 1 81 488.004 11
Mid Mid (pH 6-8) 3.57 10.94 -56.13 1 7 1 77 488.004 11

Activity (Go SEA)

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