UCSF

ZINC39890478

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 36 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 4.40 12.7 -17.99 0 8 0 97 498.564 4

Activity (Go SEA)

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