| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 28th, 2004 | 10 | Yes |
Popular Name: (4-Amino-2-methyl-5-pyrimidinyl)methanol (4-Amino-2-methyl-5-pyrimidinyl)…
(4-amino-2-methylpyrimidin-5-yl)methanol
4-Amino-5-Hydroxymethyl-2-Methylpyrimidine
5-Pyrimidinemethanol, 4-amino-2-methyl- (8CI,9CI)
| 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) | -0.97 | -1.2 | -8.06 | 3 | 4 | 0 | 72 | 139.158 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.97 | -0.91 | -27.73 | 4 | 4 | 1 | 73 | 140.166 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.97 | -4.55 | -28.96 | 4 | 4 | 1 | 73 | 140.166 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 1.20e+01 g/l | DrugBank-experimental |
| MP | 197 - 199 | Enamine Building Blocks |
| MP | 197...199 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Purity | 99% | Fluorochem |
| UniProt Database Links | COF_CITK8; COF_CROS8; COF_ECO24; COF_ECO27; COF_ECO45; COF_ECO55; COF_ECO57; COF_ECO5E; COF_ECO7I; COF_ECO81; COF_ECO8A; COF_ECOBW; COF_ECODH; COF_ECOHS; COF_ECOK1; COF_ECOL5; COF_ECOL6; COF_ECOLC; COF_ECOLI; COF_ECOLU; COF_ECOSE; COF_ECOSM; COF_ECOUT; CO | ChEBI |
| Warnings | IRRITANT | Matrix Scientific |
| Patent Database Links | US2004028612 | ChEBI |
