UCSF

ZINC05685938

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2006 23 Yes

Other Names:

MFCD01909980

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) 4.70 7.8 -13.75 1 4 0 60 310.349 3
Hi High (pH 8-9.5) 4.70 8.59 -40.72 0 4 -1 63 309.341 3

Activity (Go SEA)

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