UCSF

ZINC00703773

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 22 Yes

Other Names:

MFCD04178462

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) 3.38 -5.22 -11.23 1 5 0 71 351.84 4
Hi High (pH 8-9.5) 3.38 -4.64 -39.16 0 5 -1 74 350.832 4

Activity (Go SEA)

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