In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 14 | No |
Popular Name: [(3R)-3-(4-methylpiperazin-1-yl)tetrahydrothiophen-3-yl]methanamine [(3R)-3-(4-methylpiperazin-1-yl)…
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) | -0.25 | 2.65 | -104.63 | 4 | 3 | 2 | 35 | 217.382 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.25 | 0.18 | -49.72 | 3 | 3 | 1 | 34 | 216.374 | 2 | ↓ |