In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 21 | Yes |
Popular Name: (3S)-1-cyclopropyl-N-[(1R)-3-(4-methoxyphenyl)-1-methyl-propyl]pyrrolidin-3-amine (3S)-1-cyclopropyl-N-[(1R)-3-(4-…
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) | 3.32 | 8.66 | -33.89 | 2 | 3 | 1 | 26 | 289.443 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.32 | 6.32 | -3.43 | 1 | 3 | 0 | 24 | 288.435 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.32 | 7.17 | -43.43 | 2 | 3 | 1 | 29 | 289.443 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.32 | 9.52 | -115.23 | 3 | 3 | 2 | 30 | 290.451 | 7 | ↓ |