UCSF

ZINC02088935

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 31 Yes

Other Names:

MFCD01842162

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) 7.09 8.96 -30.93 4 5 1 90 415.513 7
Ref Reference (pH 7) 7.09 8.38 -27.96 4 5 1 90 415.513 7

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.