UCSF

ZINC66697070

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2011 17 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 1.87 6.21 -35.54 2 3 1 34 237.298 4
Hi High (pH 8-9.5) 1.87 3.83 -8.88 1 3 0 32 236.29 4

Activity (Go SEA)

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