UCSF

ZINC28631694

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 5th, 2009 32 No

Popular Name: FDA) FDA)

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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) -0.15 7.18 -74.84 4 9 -1 155 464.564 12 ↓
Hi High (pH 8-9.5) -0.15 6.16 -100.95 3 9 -2 150 463.556 12 ↓
Lo Low (pH 4.5-6) -0.15 6.06 -38.32 5 9 0 152 465.572 12 ↓

Activity (Go SEA)

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