UCSF

ZINC36322299

Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2009 25 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) 4.33 7.78 -9.56 1 4 0 47 350.34 6
Lo Low (pH 4.5-6) 4.33 8.3 -30.28 2 4 1 48 351.348 6

Activity (Go SEA)

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