UCSF

ZINC33097101

Substance Information

In ZINC since Heavy atoms Benign functionality
May 17th, 2009 28 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) 6.67 11.55 -8.9 0 4 0 44 392.524 4
Ref Reference (pH 7) 6.67 12.34 -8.58 0 4 0 44 392.524 4

Activity (Go SEA)

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