UCSF

ZINC06459036

Substance Information

In ZINC since Heavy atoms Benign functionality
March 30th, 2006 37 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) 1.58 0.37 -48.35 2 10 1 108 511.551 8
Mid Mid (pH 6-8) 1.00 0.82 -54.48 1 10 1 105 511.551 8

Activity (Go SEA)

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