In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2008 | 17 | Yes |
Popular Name: (2S,3S)-3-methyl-N-[3-(4-methyl-1-piperidyl)propyl]pentan-2-amine (2S,3S)-3-methyl-N-[3-(4-methyl-…
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) | 3.50 | 9.45 | -103.92 | 3 | 2 | 2 | 21 | 242.451 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.50 | 7.15 | -36.49 | 2 | 2 | 1 | 20 | 241.443 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.50 | 8.14 | -32.99 | 2 | 2 | 1 | 16 | 241.443 | 7 | ↓ |