In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | No |
Popular Name: (2S)-2-(1,4-thiazepan-4-ylmethyl)-3,4-dihydro-2H-1,4-benzoxazine (2S)-2-(1,4-thiazepan-4-ylmethyl…
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) | 2.34 | 7.02 | -37.59 | 2 | 3 | 1 | 26 | 265.402 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.34 | 5.4 | -5.37 | 1 | 3 | 0 | 24 | 264.394 | 2 | ↓ |