In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2010 | 10 | Yes |
Popular Name: 3-Pyridinemethanamine, 2,4-dimethyl- (9CI) 3-Pyridinemethanamine, 2,4-dimet…
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CAS Number: 588729-46-8
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) | 0.65 | 1.82 | -47.69 | 3 | 2 | 1 | 41 | 137.206 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.65 | 1.39 | -4.41 | 2 | 2 | 0 | 39 | 136.198 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.65 | 2.24 | -98.23 | 4 | 2 | 2 | 42 | 138.214 | 1 | ↓ |