UCSF

ZINC36225986

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 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) 2.01 5.95 -37.52 3 5 1 66 265.333 6
Hi High (pH 8-9.5) 2.01 3.44 -7.33 2 5 0 65 264.325 6

Activity (Go SEA)

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