UCSF

ZINC34452564

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 12 Yes

Other Names:

MFCD20661702

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) 0.75 2.6 -35.05 2 3 1 35 170.232 0
Hi High (pH 8-9.5) 0.75 1.39 -2.87 1 3 0 30 169.224 0

Activity (Go SEA)

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