UCSF

ZINC34685163

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 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) 1.80 4.1 -8.87 1 5 0 48 358.511 6
Mid Mid (pH 6-8) 1.80 6.35 -45.8 2 5 1 50 359.519 6

Activity (Go SEA)

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