In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 19 | Yes |
Popular Name: 5-[4-[(1S)-1-methylpropyl]piperazin-1-yl]sulfonylthiophen-3-amine 5-[4-[(1S)-1-methylpropyl]pipera…
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) | 1.71 | 2.93 | -41.17 | 3 | 5 | 1 | 68 | 304.461 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.71 | 1.1 | -7.82 | 2 | 5 | 0 | 67 | 303.453 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.