UCSF

ZINC21301985

Substance Information

In ZINC since Heavy atoms Benign functionality
December 3rd, 2008 22 Yes

Other Names:

MFCD01860981

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) 0.92 6.92 -42.99 3 6 0 118 304.346 7
Hi High (pH 8-9.5) 0.92 6.61 -45.89 2 6 -1 116 303.338 7

Activity (Go SEA)

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