UCSF

ZINC36091725

Substance Information

In ZINC since Heavy atoms Benign functionality
October 22nd, 2009 24 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) 1.75 4.41 -9.95 1 5 0 54 325.412 5
Lo Low (pH 4.5-6) 1.75 6.88 -44.58 2 5 1 56 326.42 5

Activity (Go SEA)

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