| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 17 | No |
Popular Name: MFCD11155640 MFCD11155640
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1021244-20-1 , N/A
HYDROXYMETHYLPIPERIDINYLBENZENECARBOXIMIDAMID
N'-Hydroxy-2-(3-methyl-1-piperidinyl)-benzenecarboximidamide
| 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 | 5.78 | -5.12 | 3 | 4 | 0 | 62 | 233.315 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.46 | 4.69 | -30.8 | 4 | 4 | 1 | 63 | 234.323 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.46 | 4.7 | -30.63 | 4 | 4 | 1 | 63 | 234.323 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.46 | 4.79 | -30.92 | 4 | 4 | 1 | 63 | 234.323 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.46 | 4.82 | -27.39 | 4 | 4 | 1 | 63 | 234.323 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.