In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 18 | Yes |
Popular Name: N-[[(2R)-1-(cyclopentylmethyl)-2-piperidyl]methyl]-2-methyl-propan-1-amine N-[[(2R)-1-(cyclopentylmethyl)-2…
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) | 3.58 | 10.43 | -115.07 | 3 | 2 | 2 | 21 | 254.462 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.58 | 9.14 | -29.05 | 2 | 2 | 1 | 16 | 253.454 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.58 | 8.44 | -35.12 | 2 | 2 | 1 | 20 | 253.454 | 6 | ↓ |