UCSF

ZINC37855228

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 19 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) 2.68 6.63 -46.99 2 2 1 30 278.2 4
Hi High (pH 8-9.5) 2.68 5.26 -4.78 1 2 0 25 277.192 4

Activity (Go SEA)

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