UCSF

ZINC36657649

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2009 18 Yes

Other Names:

F2158-0848

MFCD16631827

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) 3.27 7.75 -40.71 2 3 1 29 268.381 6
Hi High (pH 8-9.5) 3.27 5.66 -5.14 1 3 0 28 267.373 6

Activity (Go SEA)

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