In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | Yes |
Popular Name: (3R,4R)-3-(4-tert-butylpiperazin-1-yl)tetrahydropyran-4-amine (3R,4R)-3-(4-tert-butylpiperazin…
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) | 0.39 | 2.48 | -97.26 | 4 | 4 | 2 | 45 | 243.395 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.39 | 0.36 | -43.41 | 3 | 4 | 1 | 43 | 242.387 | 2 | ↓ |