In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 28 | Yes |
Popular Name: 1-[3-[[(5R)-7-[(2-fluorophenyl)methyl]-3,7-diazaspiro[4.5]decan-3-yl]methyl]phenyl]ethanone 1-[3-[[(5R)-7-[(2-fluorophenyl)m…
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) | 3.77 | 12.36 | -41.5 | 1 | 3 | 1 | 25 | 381.515 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.77 | 9.86 | -10.24 | 0 | 3 | 0 | 24 | 380.507 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.77 | 11.93 | -37.7 | 1 | 3 | 1 | 25 | 381.515 | 5 | ↓ |