UCSF

ZINC08672839

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2007 15 Yes

Other Names:

MFCD02167516

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) -0.25 0.93 -13.37 1 7 0 90 208.177 0
Mid Mid (pH 6-8) 0.20 0.15 -32.77 0 7 -1 93 207.169 0

Activity (Go SEA)

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