UCSF

ZINC17075242

Substance Information

In ZINC since Heavy atoms Benign functionality
September 13th, 2008 26 No

Other Names:

MFCD02952355

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) 5.53 11.92 -54.78 0 5 -1 74 365.434 4
Ref Reference (pH 7) 5.53 11.47 -54.86 0 5 -1 74 365.434 4

Activity (Go SEA)

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