UCSF

ZINC41247010

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2010 29 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) 2.83 8.53 -11.42 1 6 0 68 396.487 7

Activity (Go SEA)

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