UCSF

ZINC34668354

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 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) 2.10 3.53 -8.7 1 6 0 62 340.427 5
Mid Mid (pH 6-8) 2.10 5.74 -48 2 6 1 63 341.435 5

Activity (Go SEA)

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