In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 26 | Yes |
Popular Name: 9-methyl-3-[2-[methyl(2-pyridylmethyl)amino]acetyl]-3,9-diazaspiro[5.6]dodecan-10-one 9-methyl-3-[2-[methyl(2-pyridylm…
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) | 0.42 | 8.5 | -49.7 | 1 | 6 | 1 | 58 | 359.494 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.42 | 6.21 | -17.26 | 0 | 6 | 0 | 57 | 358.486 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.