UCSF

ZINC20261650

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 18 Yes

Other Names:

MFCD10031853

MFCD15142067

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) 1.01 1.74 -59.5 3 5 1 74 273.378 6
Hi High (pH 8-9.5) 1.01 1.37 -11.03 2 5 0 73 272.37 6

Activity (Go SEA)

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