In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2005 | 30 | Yes |
Popular Name: 3,5,5-trimethyl-N-[2-methyl-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoyl]butyl]-hexanamide 3,5,5-trimethyl-N-[2-methyl-1-[(…
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) | 5.46 | -0.03 | -13.38 | 2 | 6 | 0 | 83 | 430.618 | 10 | ↓ |
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 | ↓ |