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FDA-ZINC00897281

 MMsINC code: MMs01725368
Type: Neutral
Formula: C10H16N2O3
SMILES:   O=C1NC(=O)NC(=O)C1(C(CC)C)CC
InChI:   InChI=1/C10H16N2O3/c1-4-6(3)10(5-2)7(13)11-9(15)12-8(10)14/h6H,4-5H2,1-3H3,(H2,11,12,13,14,15)/t6-/m0/s1

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Drug Similarity  
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Potential Energy
Epot(MMFF94)=1.59361 kcal/mol

MOE's Descriptors


 Physical Properties
  Molecular Weight: 212.249 g/mol  logS: -2.87413  SlogP: 0.7949  Reactive groups: 0
 
 Topological Properties
  Globularity: 0.264697  Sterimol/B1: 3.90391  Sterimol/B2: 4.06161  Sterimol/B3: 4.21155
  Sterimol/B4: 4.65834  Sterimol/L: 10.8779 
 
 Surface and Volume Properties
  Accessible surface: 386.439  Positive charged surface: 233.547  Negative charged surface: 152.892  Volume: 199.375
  Hydrophobic surface: 178.63  Hydrophilic surface: 207.809
 
 Pharmacophoric Properties
  Hydrogen bond donors: 2  Hydrogen bond acceptors: 3  Acid groups: 0  Basic groups: 0
  Chiral centers: 1
 
 Drug- and Lead-like Properties
  Lipinski's drug-like rule: 1  Violations of Lipinski's rule: 0  Oprea's lead like rule: 1
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Ions/Tautomers related molecules: no related molecules available.