In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 15 | Yes |
Popular Name: N2-(4-Pyridinylmethyl)-2,3-pyridinediamine N2-(4-Pyridinylmethyl)-2,3-pyrid…
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CAS Numbers: 1040316-08-2 , N/A
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) | 0.44 | 2.86 | -8 | 3 | 4 | 0 | 64 | 200.245 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.44 | 3.23 | -33.95 | 4 | 4 | 1 | 65 | 201.253 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.44 | 3.67 | -83.92 | 5 | 4 | 2 | 66 | 202.261 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |