UCSF

ZINC00108147

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 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) 3.65 1.48 -8.11 0 6 0 74 331.368 6
Mid Mid (pH 6-8) 3.83 1.58 -7.88 0 6 0 74 331.368 6

Activity (Go SEA)

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