UCSF

ZINC26424218

Substance Information

In ZINC since Heavy atoms Benign functionality
February 6th, 2009 18 Yes

Other Names:

F2182-0156

MFCD11987042

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 4.24 -43.37 2 4 1 41 264.374 2
Hi High (pH 8-9.5) 2.36 2.64 -41.47 0 4 -1 42 262.358 2
Mid Mid (pH 6-8) 2.36 1.86 -8.94 1 4 0 40 263.366 2

Activity (Go SEA)

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