In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2010 | 15 | Yes |
Popular Name: (5R)-7-propyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine (5R)-7-propyl-2,3,4,5-tetrahydro…
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) | 1.12 | 5.4 | -46.43 | 3 | 2 | 1 | 37 | 206.309 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.12 | 5.38 | -3.14 | 2 | 2 | 0 | 35 | 205.301 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.