UCSF

ZINC34520134

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 18 Yes

Other Names:

MFCD07778445

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) 0.73 1.33 -44.33 5 5 1 86 258.386 6
Mid Mid (pH 6-8) 0.73 1.05 -5.74 4 5 0 84 257.378 6

Activity (Go SEA)

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