UCSF

ZINC35806151

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2009 35 No

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) 0.76 5.74 -68.89 5 9 0 169 491.581 8
Mid Mid (pH 6-8) 0.76 5.42 -52.45 4 9 -1 167 490.573 8

Activity (Go SEA)

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