UCSF

ZINC51943526

Substance Information

In ZINC since Heavy atoms Benign functionality
November 5th, 2010 14 No

Other Names:

MFCD15071662

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) 2.19 5.43 -12.88 1 5 0 75 256.059 1
Hi High (pH 8-9.5) 2.19 5 -33.18 0 5 -1 73 255.051 1

Activity (Go SEA)

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