UCSF

ZINC10112292

Substance Information

In ZINC since Heavy atoms Benign functionality
September 20th, 2007 34 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) 5.59 10.8 -54.74 1 7 -1 104 499.996 8
Mid Mid (pH 6-8) 5.59 10.38 -16.83 2 7 0 102 501.004 8

Activity (Go SEA)

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