UCSF

ZINC34372329

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2009 23 No

Other Names:

MFCD00057131

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) -4.02 0.38 -95.96 2 12 -2 171 343.192 1
Mid Mid (pH 6-8) -4.02 0.37 -97.73 2 12 -2 171 343.192 1

Activity (Go SEA)

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