In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 18 | No |
Popular Name: (3S)-3-(4-thiazol-2-ylpiperazin-1-yl)pentanethioamide (3S)-3-(4-thiazol-2-ylpiperazin-…
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) | 1.04 | 5.37 | -38.82 | 3 | 4 | 1 | 47 | 285.462 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.04 | 3.96 | -8.91 | 2 | 4 | 0 | 45 | 284.454 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.04 | 5.81 | -89.33 | 4 | 4 | 2 | 48 | 286.47 | 5 | ↓ |