UCSF

ZINC34676318

Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2009 33 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) 1.09 8.65 -53 2 9 1 92 453.567 6
Mid Mid (pH 6-8) 1.09 6.44 -17.15 1 9 0 91 452.559 6

Activity (Go SEA)

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