UCSF

ZINC42684370

Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2010 16 No

Other Names:

MFCD11040383

ST-7554

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) 0.62 4.65 -61.23 2 6 1 83 222.224 2
Mid Mid (pH 6-8) 0.62 3.27 -10.17 1 6 0 78 221.216 2

Activity (Go SEA)

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