UCSF

ZINC19478960

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2008 15 Yes

Other Names:

MFCD09724971

MFCD12922493

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) 0.07 1.14 -43.9 3 4 1 51 214.333 3
Hi High (pH 8-9.5) 0.07 0.85 -5.32 2 4 0 50 213.325 3

Activity (Go SEA)

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