UCSF

ZINC19990551

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 25 Yes

Other Names:

MFCD09266783

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) -1.55 -5.39 -32 4 11 0 146 353.335 3
Hi High (pH 8-9.5) -1.09 -6.51 -65.99 3 11 -1 149 352.327 3

Activity (Go SEA)

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