UCSF

ZINC00646679

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 27 Yes

Other Names:

MFCD05741292

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) 4.09 10.33 -15.06 1 5 0 56 365.477 8
Mid Mid (pH 6-8) 4.09 10.62 -37.78 2 5 1 57 366.485 8

Activity (Go SEA)

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