In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2008 | 30 | Yes |
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) | 5.67 | 10.46 | -12.26 | 2 | 6 | 0 | 84 | 507.841 | 7 | ↓ |
Popular Name: 4-chloro-N-[(1S,2R)-2-methyl-1-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]butyl]benzamide 4-chloro-N-[(1S,2R)-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) | 2.65 | 6.54 | -14.25 | 2 | 6 | 0 | 84 | 366.874 | 6 | ↓ |
Popular Name: 4-chloro-N-[(1S,2S)-2-methyl-1-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]butyl]benzamide 4-chloro-N-[(1S,2S)-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) | 2.65 | 6.56 | -14.89 | 2 | 6 | 0 | 84 | 366.874 | 6 | ↓ |
Popular Name: 4-chloro-N-[(1R,2R)-2-methyl-1-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]butyl]benzamide 4-chloro-N-[(1R,2R)-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) | 2.65 | 6.65 | -14.79 | 2 | 6 | 0 | 84 | 366.874 | 6 | ↓ |
Popular Name: 4-chloro-N-[(1R,2S)-2-methyl-1-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]butyl]benzamide 4-chloro-N-[(1R,2S)-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) | 2.65 | 6.61 | -14.23 | 2 | 6 | 0 | 84 | 366.874 | 6 | ↓ |
Popular Name: 4-chloro-N-[(1S)-2-methyl-1-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]propyl]benzamide 4-chloro-N-[(1S)-2-methyl-1-[(5-…
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) | 2.15 | 5.97 | -15.02 | 2 | 6 | 0 | 84 | 352.847 | 5 | ↓ |
Popular Name: 4-methoxy-N-[(1R)-2-methyl-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoyl]propyl]benzamide 4-methoxy-N-[(1R)-2-methyl-1-[(5…
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) | 3.74 | 7.86 | -15.58 | 2 | 7 | 0 | 93 | 410.499 | 7 | ↓ |
Popular Name: 4-tert-butyl-N-[(1R)-2-methyl-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoyl]propyl]benzamide 4-tert-butyl-N-[(1R)-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) | 5.39 | 10.87 | -14.41 | 2 | 6 | 0 | 84 | 436.581 | 7 | ↓ |
Popular Name: 4-tert-butyl-N-[(1S)-2-methyl-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoyl]propyl]benzamide 4-tert-butyl-N-[(1S)-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) | 5.39 | 10.84 | -14.39 | 2 | 6 | 0 | 84 | 436.581 | 7 | ↓ |
Popular Name: 4-methoxy-N-[(1S)-2-methyl-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoyl]propyl]benzamide 4-methoxy-N-[(1S)-2-methyl-1-[(5…
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) | 3.74 | 7.84 | -15.63 | 2 | 7 | 0 | 93 | 410.499 | 7 | ↓ |