In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 19 | Yes |
Popular Name: (3R)-3-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)quinuclidin-3-amine (3R)-3-(aminomethyl)-N-methyl-N-…
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) | 1.55 | 4.58 | -109.13 | 4 | 3 | 2 | 35 | 267.461 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.55 | 4.25 | -32.26 | 3 | 3 | 1 | 34 | 266.453 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.55 | 2.14 | -42.39 | 3 | 3 | 1 | 34 | 266.453 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.55 | 4.48 | -120.1 | 4 | 3 | 2 | 35 | 267.461 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.55 | 7.23 | -215.34 | 5 | 3 | 3 | 37 | 268.469 | 3 | ↓ |