UCSF

ZINC04412848

Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2005 25 Yes

Other Names:

MFCD06095152

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) 3.85 -2.36 -45.58 2 4 1 36 376.933 5

Activity (Go SEA)

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