In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2009 | 12 | Yes |
Popular Name: (4-methyl-1,4-diazepan-1-yl)acetic acid (4-methyl-1,4-diazepan-1-yl)acet…
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CAS Number: 1255717-82-8
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) | -1.16 | 3.48 | -30.33 | 1 | 4 | 0 | 48 | 172.228 | 2 | ↓ |
Hi High (pH 8-9.5) | -1.16 | 4.12 | -54.84 | 1 | 4 | 0 | 48 | 172.228 | 2 | ↓ |