UCSF

ZINC34668292

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2009 26 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) 3.59 8.42 -10.07 1 4 0 36 349.478 6
Mid Mid (pH 6-8) 3.59 10.63 -44.43 2 4 1 37 350.486 6

Activity (Go SEA)

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