UCSF

ZINC37246002

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 22 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) -0.54 -6.95 -14.42 5 8 0 137 314.29 4
Hi High (pH 8-9.5) -0.54 -5.04 -46.25 4 8 -1 140 313.282 4

Activity (Go SEA)

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