In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 18 | Yes |
Popular Name: (2S,3S)-3-methyl-N-[(1R)-1-[(3S)-1-propyl-3-piperidyl]ethyl]pentan-2-amine (2S,3S)-3-methyl-N-[(1R)-1-[(3S)…
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) | 4.06 | 9.53 | -95.36 | 3 | 2 | 2 | 21 | 256.478 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.06 | 8.74 | -31.16 | 2 | 2 | 1 | 16 | 255.47 | 7 | ↓ |