In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 21 | Yes |
Popular Name: (2S)-N-[(1R)-2-(diethylamino)-1-methyl-ethyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide (2S)-N-[(1R)-2-(diethylamino)-1-…
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) | 1.87 | 6.25 | -46.88 | 3 | 5 | 1 | 55 | 292.403 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.06 | 3.44 | -31.29 | 2 | 5 | 0 | 61 | 291.395 | 6 | ↓ |