UCSF

ZINC36098059

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 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) 2.27 5.18 -9.19 1 5 0 54 339.439 6
Lo Low (pH 4.5-6) 2.27 7.65 -43.1 2 5 1 56 340.447 6

Activity (Go SEA)

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