UCSF

ZINC14988378

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 15 Yes

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) 1.31 2.45 -7.62 2 3 0 49 205.257 4
Ref Reference (pH 7) 1.31 2.44 -7.6 2 3 0 49 205.257 4

Activity (Go SEA)

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