In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 29 | Yes |
Popular Name: N-methyl-N-(m-tolyl)-6-[4-(p-tolylmethyl)piperazin-1-yl]pyrimidin-4-amine N-methyl-N-(m-tolyl)-6-[4-(p-tol…
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) | 4.54 | 15.64 | -91.52 | 2 | 5 | 2 | 38 | 389.547 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.54 | 15.97 | -43.59 | 1 | 5 | 1 | 37 | 388.539 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.54 | 13.76 | -7.52 | 0 | 5 | 0 | 35 | 387.531 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.54 | 13.41 | -29.24 | 1 | 5 | 1 | 37 | 388.539 | 5 | ↓ |