UCSF

ZINC49067211

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 23rd, 2010 33 Yes

Popular Name: 1-cyclopropyl-6-fluoro-7-[4-[4-[(1S)-1-hydroxypropyl]triazol-1-yl]-1-piperidyl]-4-oxo-1,8-naphthyrid 1-cyclopropyl-6-fluoro-7-[4-[4-[…

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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) 0.55 9.81 -62.84 1 10 -1 129 455.47 6 ↓
Lo Low (pH 4.5-6) -3.04 8.56 -32.29 2 10 0 132 456.478 5 ↓

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

No pre-computed analogs available. Try a structural similarity search.