UCSF

ZINC06557485

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2006 21 Yes

Other Names:

MFCD03230487

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) 2.25 5.11 -51.51 1 6 -1 95 321.721 2
Hi High (pH 8-9.5) 2.32 4.03 -128.18 0 6 -2 102 320.713 2

Activity (Go SEA)

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