UCSF

ZINC00068337

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 19 No

Other Names:

MFCD01358626

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) 1.44 -1.27 -16.41 1 8 0 118 283.265 4
Hi High (pH 8-9.5) 1.44 -0.78 -53.96 0 8 -1 120 282.257 4

Activity (Go SEA)

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