UCSF

ZINC19774927

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2008 21 Yes

Other Names:

F2158-0415

MFCD16661012

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) 2.36 7.94 -70.24 2 5 0 74 290.363 4
Hi High (pH 8-9.5) 2.36 5.74 -59.8 1 5 -1 72 289.355 4

Activity (Go SEA)

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