UCSF

ZINC26290929

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2009 16 No

Popular Name: 3-(2-aminoethyl)-4,7-difluoro-1H-indole-5,6-diol 3-(2-aminoethyl)-4,7-difluoro-1H…

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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) 0.72 -1.35 -54.67 6 4 1 84 229.206 2 ↓
Mid Mid (pH 6-8) 0.72 -0.56 -85.39 5 4 0 87 228.198 2 ↓
Mid Mid (pH 6-8) 0.72 -0.49 -71.54 5 4 0 87 228.198 2 ↓

Activity (Go SEA)

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