UCSF

ZINC22060342

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 15 No

Other Names:

MFCD04973610

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) 0.22 -1.59 -12.2 3 5 0 78 206.201 2
Hi High (pH 8-9.5) 0.40 -3.37 -44.91 2 5 -1 85 205.193 2

Activity (Go SEA)

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