In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2010 | 28 | Yes |
Popular Name: 4-methoxy-2-[[(5S)-7-phenethyl-3,7-diazaspiro[4.5]decan-3-yl]methyl]phenol 4-methoxy-2-[[(5S)-7-phenethyl-3…
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) | 4.15 | 8.78 | -40.06 | 2 | 4 | 1 | 37 | 381.54 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.15 | 6.9 | -5.95 | 1 | 4 | 0 | 36 | 380.532 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.15 | 9.52 | -35.53 | 2 | 4 | 1 | 37 | 381.54 | 6 | ↓ |