In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 16 | Yes |
Popular Name: (3S)-1-cyclopropyl-N-[(1R)-1-methylhexyl]pyrrolidin-3-amine (3S)-1-cyclopropyl-N-[(1R)-1-met…
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) | 3.39 | 6.41 | -35.96 | 2 | 2 | 1 | 20 | 225.4 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.39 | 5.56 | -0.53 | 1 | 2 | 0 | 15 | 224.392 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.39 | 7.9 | -29.53 | 2 | 2 | 1 | 16 | 225.4 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.39 | 8.76 | -104.98 | 3 | 2 | 2 | 21 | 226.408 | 7 | ↓ |