| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 13th, 2004 | 19 | Yes |
Popular Name: Pyridine-2-carboxylic acid [3-(3-dimethylamino-propylamino)-propyl]-amide Pyridine-2-carboxylic acid [3-(3…
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CAS Number: 510764-56-4
| 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) | -0.03 | 4.84 | -108.23 | 4 | 5 | 2 | 63 | 266.389 | 9 | ↓ |
| Hi High (pH 8-9.5) | -0.03 | 3.5 | -39.7 | 3 | 5 | 1 | 58 | 265.381 | 9 | ↓ |
| Mid Mid (pH 6-8) | -0.03 | 2.36 | -47.07 | 3 | 5 | 1 | 62 | 265.381 | 9 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
