UCSF

ZINC11848939

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2008 16 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) 1.11 2.63 -48.85 1 5 -1 86 242.276 5
Hi High (pH 8-9.5) 1.11 2.7 -101.53 0 5 -2 88 241.268 5

Activity (Go SEA)

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