In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 25 | Yes |
Popular Name: 2-(4-cyclohexylpiperazin-1-yl)-N,N-dimethyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-amine 2-(4-cyclohexylpiperazin-1-yl)-N…
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) | 2.98 | 11.72 | -88.15 | 3 | 6 | 2 | 53 | 346.523 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.98 | 9.73 | -99.92 | 3 | 6 | 2 | 53 | 346.523 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 9.56 | -46.18 | 2 | 6 | 1 | 52 | 345.515 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.98 | 11.9 | -175.95 | 4 | 6 | 3 | 55 | 347.531 | 3 | ↓ |