In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2005 | 27 | Yes |
Popular Name: 2-ethyl-N-[1-[[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]carbamoyl]ethyl]hexanamide 2-ethyl-N-[1-[[5-(p-tolyl)-1,3,4…
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) | 4.83 | -0.78 | -15.15 | 2 | 6 | 0 | 83 | 388.537 | 9 | ↓ |
Popular Name: N-[[5-(4-isopropylphenyl)-1,3,4-thiadiazol-2-yl]carbamoylmethyl]-2,2-dimethyl-propanamide N-[[5-(4-isopropylphenyl)-1,3,4-…
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) | 4.77 | 7.14 | -15.07 | 2 | 6 | 0 | 84 | 360.483 | 6 | ↓ |
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) | 3.51 | 10.6 | -16.1 | 0 | 7 | 0 | 83 | 412.515 | 5 | ↓ |
Ref Reference (pH 7) | 3.51 | 10.67 | -16.24 | 0 | 7 | 0 | 83 | 412.515 | 5 | ↓ |
Ref Reference (pH 7) | 3.51 | 10.6 | -16.13 | 0 | 7 | 0 | 83 | 412.515 | 5 | ↓ |
Popular Name: (2R)-2-acetamido-2-cyclopentyl-N-[5-(4-isopropylphenyl)-1,3,4-thiadiazol-2-yl]acetamide (2R)-2-acetamido-2-cyclopentyl-N…
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) | 4.18 | 9.62 | -24.75 | 2 | 6 | 0 | 84 | 386.521 | 6 | ↓ |
Popular Name: (2S)-2-acetamido-2-cyclopentyl-N-[5-(4-isopropylphenyl)-1,3,4-thiadiazol-2-yl]acetamide (2S)-2-acetamido-2-cyclopentyl-N…
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) | 4.18 | 9.73 | -24.99 | 2 | 6 | 0 | 84 | 386.521 | 6 | ↓ |
Popular Name: (2S)-2-acetamido-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)butyramide (2S)-2-acetamido-3-methyl-N-(5-p…
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) | 2.01 | -1.43 | -15.17 | 2 | 6 | 0 | 83 | 318.402 | 5 | ↓ |
Popular Name: (2R)-2-acetamido-3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)butyramide (2R)-2-acetamido-3-methyl-N-(5-p…
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) | 2.01 | -1.52 | -14.59 | 2 | 6 | 0 | 83 | 318.402 | 5 | ↓ |