In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 18 | Yes |
Popular Name: 2-[[(3R)-3-methylpyrrolidin-3-yl]methyl]-1,3,4,5-tetrahydro-2-benzazepine 2-[[(3R)-3-methylpyrrolidin-3-yl…
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) | 2.78 | 7 | -41.47 | 2 | 2 | 1 | 20 | 245.39 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.78 | 8.47 | -103.93 | 3 | 2 | 2 | 21 | 246.398 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.