UCSF

ZINC06267460

Substance Information

In ZINC since Heavy atoms Benign functionality
March 17th, 2006 16 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) -0.80 6.6 -31.18 1 4 0 57 220.272 3
Hi High (pH 8-9.5) -0.80 4.42 -52.42 0 4 -1 56 219.264 3

Activity (Go SEA)

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