| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2010 | 14 | No |
Popular Name: (2S)-3-amino-2-methyl-N-[(3R)-1-methylpyrrolidin-3-yl]-3-thioxo-propanamide (2S)-3-amino-2-methyl-N-[(3R)-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) | -0.77 | 2.07 | -53.34 | 4 | 4 | 1 | 60 | 216.33 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.58 | 0.17 | -47.97 | 3 | 4 | 0 | 66 | 215.322 | 3 | ↓ |
