UCSF

ZINC62614830

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 4th, 2011 27 Yes

Popular Name: 1-methyl-5-[4-[(5-methylisoxazol-3-yl)methyl]piperazin-1-yl]sulfonyl-indolin-2-one 1-methyl-5-[4-[(5-methylisoxazol…

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Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 0.88 3.88 -16.56 0 8 0 87 390.465 4 ↓
Lo Low (pH 4.5-6) 0.88 6.1 -54.84 1 8 1 88 391.473 4 ↓

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

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