In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: 6-[(2,2-dimethyl-1,3-benzodioxol-5-yl)amino]-6-oxo-hexanoic 6-[(2,2-dimethyl-1,3-benzodioxol…
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) | 2.61 | 6.73 | -49.96 | 1 | 6 | -1 | 88 | 292.311 | 6 | ↓ |
Popular Name: N-(2,2-dimethyl-1,3-benzodioxol-5-yl)cyclopentanecarboxamide N-(2,2-dimethyl-1,3-benzodioxol-…
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) | 3.60 | 6.35 | -9.02 | 1 | 4 | 0 | 48 | 261.321 | 2 | ↓ |
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) | 3.76 | 6.03 | -13.01 | 1 | 4 | 0 | 48 | 249.31 | 4 | ↓ |
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) | 4.26 | 6.82 | -12.93 | 1 | 4 | 0 | 48 | 263.337 | 5 | ↓ |
Popular Name: N-(2,2-dimethyl-1,3-benzodioxol-5-yl)cycloheptanecarboxamide N-(2,2-dimethyl-1,3-benzodioxol-…
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) | 4.61 | 7.51 | -11.78 | 1 | 4 | 0 | 48 | 289.375 | 2 | ↓ |
Popular Name: 6-amino-N-(2,2-dimethyl-1,3-benzodioxol-5-yl)hexanamide 6-amino-N-(2,2-dimethyl-1,3-benz…
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) | 2.17 | 4.18 | -49.98 | 4 | 5 | 1 | 75 | 279.36 | 6 | ↓ |
Popular Name: 7-amino-N-(2,2-dimethyl-1,3-benzodioxol-5-yl)heptanamide 7-amino-N-(2,2-dimethyl-1,3-benz…
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) | 2.68 | 4.96 | -49.84 | 4 | 5 | 1 | 75 | 293.387 | 7 | ↓ |