UCSF

ZINC38580749

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 16 Yes

Other Names:

MFCD08234708

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) 0.16 5.06 -53.6 2 5 1 59 216.268 1
Hi High (pH 8-9.5) 0.16 3.76 -10.43 1 5 0 54 215.26 1

Activity (Go SEA)

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