UCSF

ZINC16082742

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 20th, 2008 13 No

Popular Name: 4-(dimethylamino)-N'-hydroxybenzenecarboximidamide 4-(dimethylamino)-N'-hydroxybenz…

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CAS Numbers: , 68451-71-8

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) 0.35 1.57 -7.73 3 4 0 62 179.223 2 ↓
Ref Reference (pH 7) 0.35 1.79 -7.1 3 4 0 62 179.223 2 ↓
Ref Reference (pH 7) 0.48 1.62 -28.6 4 4 1 61 180.231 3 ↓
Lo Low (pH 4.5-6) 0.35 2.34 -25.24 4 4 0 63 180.231 2 ↓
Lo Low (pH 4.5-6) 0.35 1.55 -31.09 4 4 1 63 180.231 2 ↓
Lo Low (pH 4.5-6) 0.35 2.55 -26.24 4 4 0 63 180.231 2 ↓
Lo Low (pH 4.5-6) 0.35 1.64 -28.67 4 4 1 63 180.231 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 169 - 171 Enamine Building Blocks
MP 169...171 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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