UCSF

ZINC04739960

Substance Information

In ZINC since Heavy atoms Benign functionality
January 2nd, 2006 21 No

Other Names:

MFCD00751568

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) 2.67 -2.64 -12.72 1 7 0 101 308.315 5
Hi High (pH 8-9.5) 2.67 -2.06 -41.18 0 7 -1 103 307.307 5

Activity (Go SEA)

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