UCSF

ZINC08969596

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2007 37 No

Other Names:

MFCD01950878

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) 6.84 16.85 -33.13 1 5 0 72 489.571 4
Mid Mid (pH 6-8) 7.23 -0.14 -21.75 0 5 0 72 489.571 4

Activity (Go SEA)

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