In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 27 | Yes |
Popular Name: 2-chloro-4-[[(5R)-9-[(2-fluorophenyl)methyl]-2,9-diazaspiro[4.5]decan-2-yl]methyl]phenol 2-chloro-4-[[(5R)-9-[(2-fluoroph…
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) | 4.28 | 9.44 | -43.92 | 2 | 3 | 1 | 28 | 389.922 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.28 | 6.99 | -6.25 | 1 | 3 | 0 | 27 | 388.914 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.28 | 10.21 | -58.18 | 1 | 3 | 0 | 31 | 388.914 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 9.13 | -38.61 | 2 | 3 | 1 | 28 | 389.922 | 4 | ↓ |