UCSF

ZINC02386642

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 14 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) -0.40 1.05 -43.74 4 5 1 83 203.262 5
Hi High (pH 8-9.5) -0.40 0.54 -6.18 3 5 0 81 202.254 5

Activity (Go SEA)

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