UCSF

ZINC09505058

Substance Information

In ZINC since Heavy atoms Benign functionality
August 29th, 2007 28 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) 4.41 -3.78 -41.24 3 4 1 62 437.361 4
Lo Low (pH 4.5-6) 4.41 -3.67 -111.06 4 4 2 63 438.369 4

Activity (Go SEA)

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