UCSF

ZINC02172170

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 28 Yes

Other Names:

MFCD04010335

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) 4.76 -0.5 -13.79 0 6 0 69 453.321 2

Activity (Go SEA)

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