UCSF

ZINC45445991

Substance Information

In ZINC since Heavy atoms Benign functionality
July 30th, 2010 16 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 2.49 5.67 -6.35 0 3 0 30 225.332 1

Activity (Go SEA)

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