UCSF

ZINC15015095

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 22 No

Download: MOL2 SDF SMILES Flexibase

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) 2.74 8.41 -11.44 3 4 0 60 327.434 3
Lo Low (pH 4.5-6) 2.74 8.12 -48.54 4 4 1 62 328.442 3

Activity (Go SEA)

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