| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2012 | 10 | Yes |
Popular Name: (R)-2-(Aminomethyl)-3,3-dimethylbutanoic acid (R)-2-(Aminomethyl)-3,3-dimethyl…
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CAS Numbers: 204191-43-5 , 367278-48-6 , 367278-49-7 , [367278-49-7]
(R)-3-Amino-4,4-dimethylpentanoic acid
(S)-2-(Aminomethyl)-3,3-dimethylbutanoicacid
2-(Aminomethyl)-3,3-dimethylbutanoic acid
| 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 | 2.35 | -43.69 | 3 | 3 | 0 | 68 | 145.202 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.44 | 2.02 | -40.25 | 2 | 3 | -1 | 66 | 144.194 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.