UCSF

ZINC13512402

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 35 No

Other Names:

MFCD00616825

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) 4.47 11.67 -9.78 0 6 0 81 489.886 2
Ref Reference (pH 7) 4.47 12.12 -11.15 0 6 0 81 489.886 2

Activity (Go SEA)

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