| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 13th, 2010 | 19 | Yes |
Popular Name: 2-amino-1-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]-2-methyl-propan-1-one 2-amino-1-[4-[(5-chloro-2-thieny…
| 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) | 1.88 | 3.12 | -49.98 | 3 | 4 | 1 | 51 | 302.851 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 2.86 | -7.43 | 2 | 4 | 0 | 50 | 301.843 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.88 | 5.04 | -101.52 | 4 | 4 | 2 | 52 | 303.859 | 3 | ↓ |
