UCSF

ZINC38811138

Substance Information

In ZINC since Heavy atoms Benign functionality
January 30th, 2010 22 No

Other Names:

MFCD00145030

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) -0.76 -7.39 -14.91 5 9 0 141 312.278 4
Hi High (pH 8-9.5) -0.76 -6.93 -57.29 4 9 -1 144 311.27 4

Activity (Go SEA)

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