UCSF

ZINC06690689

Substance Information

In ZINC since Heavy atoms Benign functionality
April 15th, 2006 26 Yes

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) 3.05 12.09 -36.29 1 5 1 53 356.421 7
Mid Mid (pH 6-8) 3.05 11.24 -8.71 0 5 0 51 355.413 7

Activity (Go SEA)

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