In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 21 | Yes |
Popular Name: (3S)-N-[(1S)-1-(4-tert-butylphenyl)ethyl]-1-cyclopropyl-pyrrolidin-3-amine (3S)-N-[(1S)-1-(4-tert-butylphen…
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) | 4.28 | 8.81 | -37.81 | 2 | 2 | 1 | 20 | 287.471 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.28 | 7.91 | -1.28 | 1 | 2 | 0 | 15 | 286.463 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 10.25 | -30.79 | 2 | 2 | 1 | 16 | 287.471 | 5 | ↓ |