UCSF

ZINC10503730

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2007 32 Yes

Popular Name: 7-[[5-(1H-indol-3-yl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-4-methyl-8-phenyl-6,9-diazabicyclo[4.3.0] 7-[[5-(1H-indol-3-yl)-1,3,4-oxad…

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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) 5.95 9.93 -17.33 1 6 0 72 437.528 5 ↓
Mid Mid (pH 6-8) 5.95 10.38 -35.01 2 6 1 73 438.536 5 ↓

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Rings

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

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