In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2011 | 21 | Yes |
Popular Name: (2R)-2-(cyclopropylamino)-4-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-methyl-butan-1-ol (2R)-2-(cyclopropylamino)-4-(3,5…
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) | 1.83 | 3.14 | -35.58 | 3 | 4 | 1 | 49 | 291.415 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.83 | 5.24 | -100.38 | 4 | 4 | 2 | 51 | 292.423 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.