UCSF

ZINC34689299

Substance Information

In ZINC since Heavy atoms Benign functionality
September 23rd, 2009 17 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) 0.91 1.36 -32.64 4 4 1 58 233.339 3
Mid Mid (pH 6-8) 0.91 3.72 -91.95 5 4 2 59 234.347 3

Activity (Go SEA)

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