In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 18 | Yes |
Popular Name: (3S)-1-cyclopropyl-N-[(3-methoxyphenyl)methyl]pyrrolidin-3-amine (3S)-1-cyclopropyl-N-[(3-methoxy…
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) | 2.04 | 6.37 | -33.06 | 2 | 3 | 1 | 26 | 247.362 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.04 | 5.2 | -41.29 | 2 | 3 | 1 | 29 | 247.362 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.04 | 4.02 | -4.05 | 1 | 3 | 0 | 24 | 246.354 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.04 | 7.54 | -112.14 | 3 | 3 | 2 | 30 | 248.37 | 5 | ↓ |