UCSF

ZINC16102449

Substance Information

In ZINC since Heavy atoms Benign functionality
August 22nd, 2008 21 No

Download: MOL2 SDF SMILES Flexibase

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) 1.39 2.19 -12.83 2 6 0 98 308.359 2
Ref Reference (pH 7) 1.39 2.26 -14.34 2 6 0 98 308.359 2
Ref Reference (pH 7) 1.39 2.2 -12.86 2 6 0 98 308.359 2

Activity (Go SEA)

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