UCSF

ZINC00251239

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 21 Yes

Other Names:

MFCD00682762

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) 2.32 -3.82 -14.65 2 5 0 75 304.371 4
Hi High (pH 8-9.5) 2.32 -3.35 -48.71 1 5 -1 77 303.363 4

Activity (Go SEA)

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