UCSF

ZINC30008640

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2009 18 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) 1.32 -1.72 -18.68 2 6 0 92 377.307 7
Hi High (pH 8-9.5) 1.32 -2.14 -42.73 1 6 -1 94 376.299 7

Activity (Go SEA)

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