UCSF

ZINC40546406

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2010 17 No

Other Names:

MFCD13705188

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) -0.53 0.78 -16.29 4 6 0 93 237.259 6

Activity (Go SEA)

Rings

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