UCSF

ZINC17167402

Substance Information

In ZINC since Heavy atoms Benign functionality
September 16th, 2008 21 No

Other Names:

MFCD02954510

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) 3.51 8.31 -7.79 0 4 0 39 297.383 2
Ref Reference (pH 7) 3.51 7.85 -8.35 0 4 0 39 297.383 2

Activity (Go SEA)

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