UCSF

ZINC58341435

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 25 Yes

Popular Name: N-cyclopropyl-N-ethyl-2-[isopropyl-[(4-oxo-3H-quinazolin-2-yl)methyl]amino]acetamide N-cyclopropyl-N-ethyl-2-[isoprop…

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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) 1.66 6.54 -31.05 1 6 0 69 342.443 7 ↓
Mid Mid (pH 6-8) 1.66 8.7 -49.54 2 6 1 70 343.451 7 ↓
Mid Mid (pH 6-8) 2.12 5.95 -48.06 1 6 0 74 342.443 7 ↓

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