In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 18 | No |
Popular Name: (2S)-2-carbamothioyl-N-methyl-N-[2-(2-pyridyl)ethyl]butanamide (2S)-2-carbamothioyl-N-methyl-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) | 0.46 | 4.92 | -16.55 | 2 | 4 | 0 | 59 | 265.382 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.46 | 5.27 | -36.39 | 3 | 4 | 1 | 60 | 266.39 | 6 | ↓ |