UCSF

ZINC19427685

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 15 No

Other Names:

MFCD09929641

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) 1.76 7.99 -45.42 1 2 1 22 204.293 2
Hi High (pH 8-9.5) 1.76 5.67 -5.07 0 2 0 20 203.285 2

Activity (Go SEA)

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