UCSF

ZINC03845116

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 22 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) 1.30 1.98 -97.89 0 10 -2 171 306.186 6

Activity (Go SEA)

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