In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2008 | 22 | Yes |
Popular Name: (2S)-2-ethyl-7-methoxy-4-(3-pyridylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine (2S)-2-ethyl-7-methoxy-4-(3-pyri…
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) | 2.67 | 0.95 | -41.97 | 1 | 4 | 1 | 36 | 299.394 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.67 | 1.06 | -105.84 | 2 | 4 | 2 | 37 | 300.402 | 4 | ↓ |