In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 29th, 2009 | 11 | Yes |
Popular Name: D-Alanine, 3-(diethylamino)- (9CI) D-Alanine, 3-(diethylamino)- (9CI)
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CAS Number: 739363-49-6
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) | -2.25 | 3.1 | -78.14 | 4 | 4 | 1 | 72 | 161.225 | 5 | ↓ |
Hi High (pH 8-9.5) | -2.25 | 2.75 | -38.68 | 3 | 4 | 0 | 71 | 160.217 | 5 | ↓ |
Mid Mid (pH 6-8) | -2.25 | 1.36 | -32.31 | 3 | 4 | 0 | 71 | 160.217 | 5 | ↓ |