UCSF

ZINC37981502

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2009 20 No

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) -2.01 -1.38 -48.76 5 8 1 118 282.324 4
Hi High (pH 8-9.5) -2.01 -3.56 -14.35 4 8 0 117 281.316 4

Activity (Go SEA)

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