| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 16 | No |
Popular Name: 2-[(3-amino-3-thioxo-propyl)-ethyl-amino]-N-butyl-acetamide 2-[(3-amino-3-thioxo-propyl)-eth…
| 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) | 0.95 | 4.01 | -44.02 | 4 | 4 | 1 | 60 | 246.4 | 9 | ↓ |
| Hi High (pH 8-9.5) | 0.95 | 1.95 | -12.77 | 3 | 4 | 0 | 58 | 245.392 | 9 | ↓ |
