UCSF

ZINC46171277

Substance Information

In ZINC since Heavy atoms Benign functionality
August 9th, 2010 24 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) 2.65 9 -36.56 1 4 1 28 330.496 4
Mid Mid (pH 6-8) 2.65 6.8 -7.77 0 4 0 27 329.488 4

Activity (Go SEA)

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