UCSF

ZINC19795667

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2008 20 Yes

Popular Name: (3S)-3-amino-5-fluoro-1-[(4-fluorophenyl)methyl]indolin-2-one (3S)-3-amino-5-fluoro-1-[(4-fluo…

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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) 0.37 5.84 -7.62 2 3 0 46 274.27 2 ↓
Lo Low (pH 4.5-6) 0.37 6.15 -49.56 3 3 1 48 275.278 2 ↓

Activity (Go SEA)

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