In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 16 | Yes |
Popular Name: 4-amino-2-(4-methyl-1-piperidinyl)-5-pyrimidinecarbonitrile 4-amino-2-(4-methyl-1-piperidiny…
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) | 1.46 | 5.15 | -6.17 | 2 | 5 | 0 | 79 | 217.276 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.46 | 5.55 | -36.15 | 3 | 5 | 1 | 80 | 218.284 | 1 | ↓ |