UCSF

ZINC00423528

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 23 Yes

Other Names:

MFCD03388953

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) 3.05 -4.1 -17.45 1 5 0 68 328.393 5
Hi High (pH 8-9.5) 3.05 -3.54 -61.26 0 5 -1 70 327.385 5

Activity (Go SEA)

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