UCSF

ZINC48545890

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2010 20 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) -1.30 1.34 -59.88 3 7 1 83 283.352 3
Mid Mid (pH 6-8) -1.30 -0.88 -27.21 2 7 0 82 282.344 3

Activity (Go SEA)

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