UCSF

ZINC12464625

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 32 No

Other Names:

MFCD02955234

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) 7.91 14.83 -9.18 0 4 0 44 463.002 6
Ref Reference (pH 7) 7.91 15.25 -9.31 0 4 0 44 463.002 6

Activity (Go SEA)

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