UCSF

ZINC00706599

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 31 Yes

Other Names:

MFCD01142534

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) 5.15 0.86 -12.74 1 6 0 65 416.477 7
Mid Mid (pH 6-8) 5.15 1.06 -36.31 2 6 1 66 417.485 7

Activity (Go SEA)

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