| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2010 | 19 | No |
Popular Name: (2S)-2-[4-(cyclopropylmethyl)piperazine-1-carbonyl]pentanethioamide (2S)-2-[4-(cyclopropylmethyl)pip…
| 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) | 1.15 | 4.38 | -5.17 | 2 | 4 | 0 | 50 | 283.441 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.15 | 6.59 | -39.57 | 3 | 4 | 1 | 51 | 284.449 | 6 | ↓ |
