In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 16 | Yes |
Popular Name: N2-[(3S)-1-cyclopropylpyrrolidin-3-yl]benzene-1,2-diamine N2-[(3S)-1-cyclopropylpyrrolidin…
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) | 2.41 | 5.41 | -35.17 | 4 | 3 | 1 | 42 | 218.324 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.41 | 3.07 | -2.76 | 3 | 3 | 0 | 41 | 217.316 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.41 | 5.27 | -94.99 | 5 | 3 | 2 | 44 | 219.332 | 3 | ↓ |