UCSF

ZINC06729706

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2006 15 Yes

Other Names:

MFCD07411171

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) 2.14 -0.58 -35.22 2 3 1 35 230.715 6

Activity (Go SEA)

Rings

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